COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.140  -0.513   0.257  1.00  0.00           C  
HETATM    2  C   UNL     1       0.992   0.851   2.073  1.00  0.00           C  
HETATM    3  C   UNL     1       3.342  -1.040  -1.416  1.00  0.00           C  
HETATM    4  C   UNL     1       4.445  -1.871  -1.478  1.00  0.00           C  
HETATM    5  C   UNL     1       4.463  -3.027  -2.444  1.00  0.00           C  
HETATM    6  C   UNL     1       5.515  -0.580   0.231  1.00  0.00           C  
HETATM    7  C   UNL     1       4.410   0.248   0.298  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.686  -1.976   1.384  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.378  -1.347   0.975  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.148   0.179  -0.372  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.178   1.489  -0.835  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.999   2.139  -1.150  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.789   1.490  -1.003  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.752   0.180  -0.541  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.435   0.211  -0.002  1.00  0.00           C  
HETATM   16  C   UNL     1       3.325   0.021  -0.530  1.00  0.00           C  
HETATM   17  C   UNL     1       5.531  -1.641  -0.655  1.00  0.00           C  
HETATM   18  C   UNL     1       6.699  -0.329   1.128  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.933  -0.474  -0.220  1.00  0.00           C  
HETATM   20  F   UNL     1       7.219   0.944   0.869  1.00  0.00           F  
HETATM   21  F   UNL     1       6.295  -0.404   2.466  1.00  0.00           F  
HETATM   22  N   UNL     1      -7.341  -0.478  -0.054  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.526  -0.477  -0.394  1.00  0.00           N  
HETATM   24  N   UNL     1       0.885   0.450   0.668  1.00  0.00           N  
HETATM   25  O   UNL     1      -6.360  -1.622   1.574  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.497   1.414   0.143  1.00  0.00           O  
HETATM   27  O   UNL     1       2.383   2.319   0.076  1.00  0.00           O  
HETATM   28  O   UNL     1       1.269   0.976  -1.712  1.00  0.00           O  
HETATM   29  S   UNL     1       1.923   1.085  -0.455  1.00  0.00           S  
HETATM   30  H   UNL     1      -0.286  -1.248   1.049  1.00  0.00           H  
HETATM   31  H   UNL     1       0.182  -1.019  -0.653  1.00  0.00           H  
HETATM   32  H   UNL     1       1.675   0.179   2.592  1.00  0.00           H  
HETATM   33  H   UNL     1       1.371   1.871   2.132  1.00  0.00           H  
HETATM   34  H   UNL     1       0.008   0.802   2.541  1.00  0.00           H  
HETATM   35  H   UNL     1       2.495  -1.217  -2.062  1.00  0.00           H  
HETATM   36  H   UNL     1       4.884  -2.700  -3.395  1.00  0.00           H  
HETATM   37  H   UNL     1       5.073  -3.833  -2.035  1.00  0.00           H  
HETATM   38  H   UNL     1       3.446  -3.386  -2.601  1.00  0.00           H  
HETATM   39  H   UNL     1       4.397   1.077   0.990  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.829  -2.905   0.833  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.669  -2.187   2.453  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.504  -1.291   1.161  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.122   1.999  -0.950  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.025   3.157  -1.510  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.870   2.000  -1.251  1.00  0.00           H  
HETATM   46  H   UNL     1       6.394  -2.288  -0.707  1.00  0.00           H  
HETATM   47  H   UNL     1       7.465  -1.081   0.938  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.907  -1.490   0.144  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.142  -0.309  -0.575  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.460  -1.428  -0.574  1.00  0.00           H  
CONECT    1   15   24   30   31                                       
CONECT    2   24   32   33   34                                       
CONECT    3   16   16    4   35                                       
CONECT    4    3    5   17   17                                       
CONECT    5    4   36   37   38                                       
CONECT    6   17   18    7    7                                       
CONECT    7    6    6   16   39                                       
CONECT    8    9   40   41   42                                       
CONECT    9    8   25   25   22                                       
CONECT   10   22   11   11   19                                       
CONECT   11   10   10   12   43                                       
CONECT   12   11   13   13   44                                       
CONECT   13   12   12   14   45                                       
CONECT   14   13   23   19   19                                       
CONECT   15   23   26   26    1                                       
CONECT   16   29    3    3    7                                       
CONECT   17    4    4    6   46                                       
CONECT   18   20   21    6   47                                       
CONECT   19   14   14   10   48                                       
CONECT   20   18                                                      
CONECT   21   18                                                      
CONECT   22    9   10   49                                            
CONECT   23   15   14   50                                            
CONECT   24    1    2   29                                            
CONECT   25    9    9                                                 
CONECT   26   15   15                                                 
CONECT   27   29   29                                                 
CONECT   28   29   29                                                 
CONECT   29   24   27   27   28                                       
CONECT   29   28   16                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
