COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.874  -1.633   0.061  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.824  -0.693  -0.303  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.160   1.033  -0.208  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.467   0.639  -0.437  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.270   3.504   1.160  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.001   5.009   1.101  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.207   0.093   0.156  1.00  0.00           C  
HETATM    8  C   UNL     1       2.024  -0.108  -0.601  1.00  0.00           C  
HETATM    9  C   UNL     1       2.384   0.941  -1.652  1.00  0.00           C  
HETATM   10  C   UNL     1       3.492   0.370  -2.545  1.00  0.00           C  
HETATM   11  C   UNL     1       4.777   0.285  -1.723  1.00  0.00           C  
HETATM   12  C   UNL     1       4.527  -0.427  -0.419  1.00  0.00           C  
HETATM   13  C   UNL     1       3.263  -0.603   0.098  1.00  0.00           C  
HETATM   14  C   UNL     1       3.102  -1.261   1.311  1.00  0.00           C  
HETATM   15  C   UNL     1       4.197  -1.743   1.998  1.00  0.00           C  
HETATM   16  C   UNL     1       5.465  -1.570   1.476  1.00  0.00           C  
HETATM   17  C   UNL     1       5.628  -0.914   0.273  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.567  -1.244   0.290  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.375  -3.911   1.110  1.00  0.00           O  
HETATM   20  S   UNL     1      -2.333  -3.325   0.238  1.00  0.00           S  
HETATM   21  O   UNL     1      -3.730  -3.337   0.498  1.00  0.00           O  
HETATM   22  N   UNL     1      -2.125  -4.047  -1.238  1.00  0.00           N  
HETATM   23  F   UNL     1       0.359  -2.161   0.645  1.00  0.00           F  
HETATM   24  S   UNL     1      -0.707   2.727  -0.379  1.00  0.00           S  
HETATM   25  O   UNL     1       0.712   2.706  -0.437  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.445   5.620   2.314  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.478   3.187  -1.481  1.00  0.00           O  
HETATM   28  F   UNL     1      -3.395   1.554  -0.792  1.00  0.00           F  
HETATM   29  F   UNL     1      -4.100  -1.076  -0.526  1.00  0.00           F  
HETATM   30  N   UNL     1       1.115   0.489   0.387  1.00  0.00           N  
HETATM   31  H   UNL     1      -0.732   3.071   2.004  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.339   3.331   1.285  1.00  0.00           H  
HETATM   33  H   UNL     1       0.068   5.182   0.977  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.539   5.441   0.258  1.00  0.00           H  
HETATM   35  H   UNL     1       1.526  -0.947  -1.086  1.00  0.00           H  
HETATM   36  H   UNL     1       1.507   1.170  -2.257  1.00  0.00           H  
HETATM   37  H   UNL     1       2.738   1.847  -1.161  1.00  0.00           H  
HETATM   38  H   UNL     1       3.210  -0.626  -2.888  1.00  0.00           H  
HETATM   39  H   UNL     1       3.646   1.024  -3.402  1.00  0.00           H  
HETATM   40  H   UNL     1       5.531  -0.259  -2.291  1.00  0.00           H  
HETATM   41  H   UNL     1       5.139   1.293  -1.518  1.00  0.00           H  
HETATM   42  H   UNL     1       2.111  -1.396   1.719  1.00  0.00           H  
HETATM   43  H   UNL     1       4.064  -2.254   2.940  1.00  0.00           H  
HETATM   44  H   UNL     1       6.326  -1.946   2.008  1.00  0.00           H  
HETATM   45  H   UNL     1       6.619  -0.780  -0.135  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.326  -4.989  -1.350  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.802  -3.527  -1.991  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.305   6.577   2.346  1.00  0.00           H  
HETATM   49  H   UNL     1       1.403   0.260   1.327  1.00  0.00           H  
CONECT    1   20   18   18    2                                       
CONECT    2    1   29    4    4                                       
CONECT    3    7    7    4   24                                       
CONECT    4    2    2    3   28                                       
CONECT    5   24    6   31   32                                       
CONECT    6   26    5   33   34                                       
CONECT    7   18   30    3    3                                       
CONECT    8   13    9   30   35                                       
CONECT    9    8   10   36   37                                       
CONECT   10   11    9   38   39                                       
CONECT   11   12   10   40   41                                       
CONECT   12   17   17   13   11                                       
CONECT   13   14   14   12    8                                       
CONECT   14   15   13   13   42                                       
CONECT   15   16   16   14   43                                       
CONECT   16   15   15   17   44                                       
CONECT   17   16   12   12   45                                       
CONECT   18   23    1    1    7                                       
CONECT   19   20   20                                                 
CONECT   20   21   21   19   19                                       
CONECT   20   22    1                                                 
CONECT   21   20   20                                                 
CONECT   22   20   46   47                                            
CONECT   23   18                                                      
CONECT   24    3   25   25   27                                       
CONECT   24   27    5                                                 
CONECT   25   24   24                                                 
CONECT   26    6   48                                                 
CONECT   27   24   24                                                 
CONECT   28    4                                                      
CONECT   29    2                                                      
CONECT   30    8    7   49                                            
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   30                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
