COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.888  -4.080  -2.355  1.00  0.00           C  
HETATM    2  C   UNL     1       1.207   1.329   0.391  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.904   2.342   0.870  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.874   0.120   0.249  1.00  0.00           C  
HETATM    5  C   UNL     1       1.164   3.745   1.067  1.00  0.00           C  
HETATM    6  C   UNL     1       2.138   6.218   0.130  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.945   0.238  -0.421  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.039  -2.016   0.394  1.00  0.00           C  
HETATM    9  N   UNL     1       4.649  -2.911   1.140  1.00  0.00           N  
HETATM   10  N   UNL     1       4.202  -1.742   1.764  1.00  0.00           N  
HETATM   11  C   UNL     1       3.148  -1.113   1.372  1.00  0.00           C  
HETATM   12  N   UNL     1       2.390  -1.558   0.307  1.00  0.00           N  
HETATM   13  C   UNL     1       2.768  -2.708  -0.362  1.00  0.00           C  
HETATM   14  C   UNL     1       3.970  -3.415   0.085  1.00  0.00           C  
HETATM   15  C   UNL     1       1.257  -1.075  -0.283  1.00  0.00           C  
HETATM   16  C   UNL     1       0.915  -1.915  -1.324  1.00  0.00           C  
HETATM   17  C   UNL     1       1.862  -2.936  -1.375  1.00  0.00           C  
HETATM   18  O   UNL     1       4.343  -4.433  -0.473  1.00  0.00           O  
HETATM   19  C   UNL     1       0.522   0.139   0.124  1.00  0.00           C  
HETATM   20  C   UNL     1       0.471   2.440   0.768  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.529   1.209   0.613  1.00  0.00           N  
HETATM   22  O   UNL     1      -1.558  -1.023  -0.005  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.916  -0.969  -0.004  1.00  0.00           C  
HETATM   24  S   UNL     1       1.289   4.725  -0.455  1.00  0.00           S  
HETATM   25  O   UNL     1       2.145   4.044  -1.362  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.021   5.083  -0.872  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.565   0.186  -0.417  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.683  -0.860  -0.013  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.657  -2.074   0.394  1.00  0.00           C  
HETATM   30  F   UNL     1      -3.028  -3.205   0.782  1.00  0.00           F  
HETATM   31  F   UNL     1      -7.033  -0.804  -0.013  1.00  0.00           F  
HETATM   32  H   UNL     1       2.466  -3.793  -3.233  1.00  0.00           H  
HETATM   33  H   UNL     1       2.348  -4.950  -1.886  1.00  0.00           H  
HETATM   34  H   UNL     1       0.869  -4.325  -2.654  1.00  0.00           H  
HETATM   35  H   UNL     1       2.282   1.380   0.309  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.477   3.209   1.164  1.00  0.00           H  
HETATM   37  H   UNL     1       0.591   4.299   1.810  1.00  0.00           H  
HETATM   38  H   UNL     1       2.163   3.545   1.454  1.00  0.00           H  
HETATM   39  H   UNL     1       1.536   6.699   0.901  1.00  0.00           H  
HETATM   40  H   UNL     1       3.108   5.945   0.544  1.00  0.00           H  
HETATM   41  H   UNL     1       2.279   6.906  -0.704  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.450   1.139  -0.738  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.615  -2.872   0.712  1.00  0.00           H  
HETATM   44  H   UNL     1       5.448  -3.358   1.462  1.00  0.00           H  
HETATM   45  H   UNL     1       2.849  -0.214   1.891  1.00  0.00           H  
HETATM   46  H   UNL     1       0.067  -1.800  -1.982  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.991   1.043  -0.735  1.00  0.00           H  
CONECT    1   17   32   33   34                                       
CONECT    2   20   20   19   35                                       
CONECT    3   20   21   21   36                                       
CONECT    4   19   19   21   22                                       
CONECT    5   24   20   37   38                                       
CONECT    6   24   39   40   41                                       
CONECT    7   27   27   28   42                                       
CONECT    8   29   28   28   43                                       
CONECT    9   14   10   44                                            
CONECT   10    9   11   11                                            
CONECT   11   12   10   10   45                                       
CONECT   12   13   15   11                                            
CONECT   13   17   17   14   12                                       
CONECT   14   18   18   13    9                                       
CONECT   15   16   16   19   12                                       
CONECT   16   17   15   15   46                                       
CONECT   17    1   16   13   13                                       
CONECT   18   14   14                                                 
CONECT   19    2   15    4    4                                       
CONECT   20    5    2    2    3                                       
CONECT   21    3    3    4                                            
CONECT   22    4   23                                                 
CONECT   23   22   29   29   27                                       
CONECT   24    6   25   25   26                                       
CONECT   24   26    5                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27   23    7    7   47                                       
CONECT   28    8    8    7   31                                       
CONECT   29   30   23   23    8                                       
CONECT   30   29                                                      
CONECT   31   28                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   16                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
