COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.816   0.208   0.582  1.00  0.00           C  
HETATM    2  C   UNL     1       3.583   0.627   0.135  1.00  0.00           C  
HETATM    3  C   UNL     1       2.806  -1.661   0.198  1.00  0.00           C  
HETATM    4  C   UNL     1       0.665  -1.422  -0.493  1.00  0.00           C  
HETATM    5  C   UNL     1       1.271   2.232  -0.140  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.859   1.003  -0.458  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.211   0.585   0.812  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.543   0.536   1.179  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.523   0.906   0.276  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.839   1.373  -1.360  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.705  -0.704  -0.273  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.112  -3.134  -0.357  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.021  -4.127  -0.768  1.00  0.00           C  
HETATM   14  C   UNL     1       1.266  -3.828   0.003  1.00  0.00           C  
HETATM   15  F   UNL     1       6.275  -1.530   1.273  1.00  0.00           F  
HETATM   16  C   UNL     1       5.059  -1.137   0.835  1.00  0.00           C  
HETATM   17  S   UNL     1       3.296   2.335  -0.187  1.00  0.00           S  
HETATM   18  O   UNL     1       2.378   2.732   0.822  1.00  0.00           O  
HETATM   19  O   UNL     1       4.597   2.901  -0.259  1.00  0.00           O  
HETATM   20  C   UNL     1       2.500   2.361  -1.817  1.00  0.00           C  
HETATM   21  C   UNL     1       2.564  -0.299  -0.063  1.00  0.00           C  
HETATM   22  N   UNL     1       1.254  -0.190  -0.481  1.00  0.00           N  
HETATM   23  C   UNL     1       0.593   1.063  -0.856  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.171   1.325  -0.993  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.975   0.852   0.676  1.00  0.00           C  
HETATM   26  F   UNL     1      -5.184  -0.241   1.525  1.00  0.00           F  
HETATM   27  F   UNL     1      -5.319   2.033   1.343  1.00  0.00           F  
HETATM   28  F   UNL     1      -5.768   0.713  -0.467  1.00  0.00           F  
HETATM   29  C   UNL     1      -0.760  -1.739  -0.886  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.124  -1.205  -0.360  1.00  0.00           C  
HETATM   31  O   UNL     1      -3.348  -2.311  -0.790  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.138  -0.422   0.040  1.00  0.00           O  
HETATM   33  C   UNL     1       1.557  -2.353  -0.104  1.00  0.00           C  
HETATM   34  C   UNL     1       4.065  -2.072   0.642  1.00  0.00           C  
HETATM   35  H   UNL     1       5.604   0.931   0.733  1.00  0.00           H  
HETATM   36  H   UNL     1       1.486   1.951   0.891  1.00  0.00           H  
HETATM   37  H   UNL     1       2.201   2.481  -0.650  1.00  0.00           H  
HETATM   38  H   UNL     1       0.609   3.098  -0.149  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.446   0.296   1.516  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.818   0.208   2.170  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.564   1.700  -2.352  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.440  -0.543   0.772  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.617   0.236  -0.819  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.067  -3.451  -0.775  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.184  -3.103   0.730  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.352  -5.142  -0.549  1.00  0.00           H  
HETATM   47  H   UNL     1       0.175  -4.031  -1.836  1.00  0.00           H  
HETATM   48  H   UNL     1       1.134  -4.092   1.052  1.00  0.00           H  
HETATM   49  H   UNL     1       2.089  -4.402  -0.422  1.00  0.00           H  
HETATM   50  H   UNL     1       1.529   1.869  -1.755  1.00  0.00           H  
HETATM   51  H   UNL     1       2.364   3.393  -2.139  1.00  0.00           H  
HETATM   52  H   UNL     1       3.128   1.835  -2.536  1.00  0.00           H  
HETATM   53  H   UNL     1       0.669   1.204  -1.934  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.936   1.614  -1.698  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.852  -1.725  -1.972  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.022  -0.812   0.035  1.00  0.00           H  
HETATM   57  H   UNL     1       4.257  -3.116   0.840  1.00  0.00           H  
CONECT    1   16    2    2   35                                       
CONECT    2    1    1   21   17                                       
CONECT    3   34   33   21   21                                       
CONECT    4   33   33   29   22                                       
CONECT    5   23   36   37   38                                       
CONECT    6    7   23   10   10                                       
CONECT    7    8    8    6   39                                       
CONECT    8    7    7    9   40                                       
CONECT    9    8   25   24   24                                       
CONECT   10    6    6   24   41                                       
CONECT   11   29   30   42   43                                       
CONECT   12   13   29   44   45                                       
CONECT   13   14   12   46   47                                       
CONECT   14   13   33   48   49                                       
CONECT   15   16                                                      
CONECT   16   15   34   34    1                                       
CONECT   17    2   20   18   18                                       
CONECT   17   19   19                                                 
CONECT   18   17   17                                                 
CONECT   19   17   17                                                 
CONECT   20   17   50   51   52                                       
CONECT   21    3    3    2   22                                       
CONECT   22    4   21   23                                            
CONECT   23   22    6    5   53                                       
CONECT   24    9    9   10   54                                       
CONECT   25   26    9   27   28                                       
CONECT   26   25                                                      
CONECT   27   25                                                      
CONECT   28   25                                                      
CONECT   29   12    4   11   55                                       
CONECT   30   31   31   11   32                                       
CONECT   31   30   30                                                 
CONECT   32   30   56                                                 
CONECT   33   14    3    4    4                                       
CONECT   34   16   16    3   57                                       
CONECT   35    1                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   29                                                      
CONECT   56   32                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
