COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.816   3.705   1.226  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.305   4.371  -0.062  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.425   0.988  -0.731  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.751  -1.238   0.110  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.405  -4.788   0.829  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.312  -4.921   0.070  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.884  -0.806   0.802  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.275   0.515   0.722  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.548   1.410  -0.043  1.00  0.00           C  
HETATM   10  C   UNL     1       2.247   1.000  -0.596  1.00  0.00           C  
HETATM   11  C   UNL     1       5.780  -0.992  -0.118  1.00  0.00           C  
HETATM   12  C   UNL     1       2.470   2.003   1.577  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.102   1.061  -1.347  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.377   2.015  -0.645  1.00  0.00           C  
HETATM   15  N   UNL     1       0.539   2.505   0.214  1.00  0.00           N  
HETATM   16  C   UNL     1       1.756   1.834   0.399  1.00  0.00           C  
HETATM   17  C   UNL     1       3.669   1.342   1.759  1.00  0.00           C  
HETATM   18  C   UNL     1       4.157   0.505   0.766  1.00  0.00           C  
HETATM   19  O   UNL     1       5.337  -0.146   0.945  1.00  0.00           O  
HETATM   20  F   UNL     1       7.001  -1.579   0.230  1.00  0.00           F  
HETATM   21  F   UNL     1       4.829  -1.993  -0.343  1.00  0.00           F  
HETATM   22  F   UNL     1       5.942  -0.233  -1.281  1.00  0.00           F  
HETATM   23  C   UNL     1       3.444   0.335  -0.412  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.596   2.583  -0.725  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.883   3.812   0.019  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.636   1.971  -1.557  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.023  -0.330  -0.659  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.326  -2.652   0.191  1.00  0.00           C  
HETATM   29  S   UNL     1      -1.934  -3.350  -0.632  1.00  0.00           S  
HETATM   30  N   UNL     1      -3.927  -3.584   0.874  1.00  0.00           N  
HETATM   31  H   UNL     1      -2.610   4.351   2.080  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.217   2.721   1.467  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.027   3.825  -0.668  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.421   5.455  -0.055  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.835  -5.620   1.368  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.757  -5.834  -0.085  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.452  -1.504   1.399  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.151   0.850   1.257  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.859   2.442  -0.103  1.00  0.00           H  
HETATM   40  H   UNL     1       1.692   0.867  -1.513  1.00  0.00           H  
HETATM   41  H   UNL     1       2.089   2.652   2.352  1.00  0.00           H  
HETATM   42  H   UNL     1       0.357   3.322   0.704  1.00  0.00           H  
HETATM   43  H   UNL     1       4.225   1.474   2.675  1.00  0.00           H  
HETATM   44  H   UNL     1       3.824  -0.317  -1.184  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.063   4.528   0.078  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.171   1.451  -2.395  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.302   2.746  -1.934  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.146  -0.659  -1.197  1.00  0.00           H  
CONECT    1   25    2   31   32                                       
CONECT    2    1   25   33   34                                       
CONECT    3   26    9    9   27                                       
CONECT    4   27   27    7   28                                       
CONECT    5    6    6   30   35                                       
CONECT    6   29    5    5   36                                       
CONECT    7    8    8    4   37                                       
CONECT    8    9    7    7   38                                       
CONECT    9    3    3    8   39                                       
CONECT   10   16   16   23   40                                       
CONECT   11   20   19   22   21                                       
CONECT   12   17   17   16   41                                       
CONECT   13   14   14                                                 
CONECT   14   15   24   13   13                                       
CONECT   15   16   14   42                                            
CONECT   16   12   15   10   10                                       
CONECT   17   12   12   18   43                                       
CONECT   18   17   19   23   23                                       
CONECT   19   18   11                                                 
CONECT   20   11                                                      
CONECT   21   11                                                      
CONECT   22   11                                                      
CONECT   23   18   18   10   44                                       
CONECT   24   25   14   26                                            
CONECT   25    1    2   24   45                                       
CONECT   26   24    3   46   47                                       
CONECT   27    3    4    4   48                                       
CONECT   28    4   29   30   30                                       
CONECT   29   28    6                                                 
CONECT   30   28   28    5                                            
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
