COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.757  -1.027  -0.021  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.942  -0.199  -0.028  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.689   1.136  -0.020  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.174   0.881  -0.028  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.912   0.746   1.060  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.614   0.469  -0.555  1.00  0.00           C  
HETATM    7  N   UNL     1      -9.883   0.075  -0.068  1.00  0.00           N  
HETATM    8  C   UNL     1      -9.643   0.106   1.233  1.00  0.00           C  
HETATM    9  C   UNL     1       5.818  -1.351   0.012  1.00  0.00           C  
HETATM   10  C   UNL     1       4.928  -0.275   0.017  1.00  0.00           C  
HETATM   11  C   UNL     1       5.446   1.115   0.036  1.00  0.00           C  
HETATM   12  C   UNL     1       1.618  -2.064  -0.020  1.00  0.00           C  
HETATM   13  C   UNL     1       5.342  -2.648  -0.006  1.00  0.00           C  
HETATM   14  C   UNL     1       7.297   2.643   0.067  1.00  0.00           C  
HETATM   15  C   UNL     1       5.046   3.482   0.048  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.687  -1.276  -0.028  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.434   0.060  -0.021  1.00  0.00           C  
HETATM   18  S   UNL     1      -6.144   0.732  -1.481  1.00  0.00           S  
HETATM   19  C   UNL     1      -7.320   0.507   0.814  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.931   0.249  -0.958  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.389   0.317   1.719  1.00  0.00           C  
HETATM   22  O   UNL     1       6.214  -3.691  -0.017  1.00  0.00           O  
HETATM   23  O   UNL     1       3.504  -4.163  -0.029  1.00  0.00           O  
HETATM   24  C   UNL     1       3.073  -1.814  -0.013  1.00  0.00           C  
HETATM   25  C   UNL     1       3.558  -0.505   0.005  1.00  0.00           C  
HETATM   26  C   UNL     1       3.970  -2.889  -0.013  1.00  0.00           C  
HETATM   27  C   UNL     1       6.820   1.349   0.049  1.00  0.00           C  
HETATM   28  C   UNL     1       6.413   3.710   0.072  1.00  0.00           C  
HETATM   29  C   UNL     1       4.560   2.191   0.036  1.00  0.00           C  
HETATM   30  F   UNL     1       6.884   4.976   0.083  1.00  0.00           F  
HETATM   31  O   UNL     1       1.198  -3.204  -0.026  1.00  0.00           O  
HETATM   32  H   UNL     1       1.092  -0.117  -0.013  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.216  -0.774   0.856  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.210  -0.760  -0.924  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.421   1.697   0.875  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.415   1.711  -0.905  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.497   0.809   2.055  1.00  0.00           H  
HETATM   38  H   UNL     1     -10.460  -0.043   1.924  1.00  0.00           H  
HETATM   39  H   UNL     1       6.883  -1.168   0.017  1.00  0.00           H  
HETATM   40  H   UNL     1       8.361   2.826   0.077  1.00  0.00           H  
HETATM   41  H   UNL     1       4.360   4.316   0.052  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.955  -1.836  -0.924  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.961  -1.850   0.856  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.160   0.635  -0.905  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.166   0.621   0.875  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.171   0.221  -2.010  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.214   0.339   2.785  1.00  0.00           H  
HETATM   48  H   UNL     1       6.465  -4.004   0.863  1.00  0.00           H  
HETATM   49  H   UNL     1       3.366  -4.543   0.849  1.00  0.00           H  
HETATM   50  H   UNL     1       2.870   0.327   0.009  1.00  0.00           H  
HETATM   51  H   UNL     1       7.510   0.518   0.045  1.00  0.00           H  
HETATM   52  H   UNL     1       3.495   2.014   0.026  1.00  0.00           H  
CONECT    1   12   16   32                                            
CONECT    2   17    3   33   34                                       
CONECT    3    2    4   35   36                                       
CONECT    4    3    5    5   18                                       
CONECT    5    4    4   19   37                                       
CONECT    6   18   19   19   20                                       
CONECT    7   20   20    8                                            
CONECT    8   21   21    7   38                                       
CONECT    9   10   13   13   39                                       
CONECT   10   11   25   25    9                                       
CONECT   11   29   29   27   10                                       
CONECT   12   31   31   24    1                                       
CONECT   13    9    9   26   22                                       
CONECT   14   28   27   27   40                                       
CONECT   15   28   28   29   41                                       
CONECT   16   17    1   42   43                                       
CONECT   17    2   16   44   45                                       
CONECT   18    4    6                                                 
CONECT   19    5    6    6   21                                       
CONECT   20    6    7    7   46                                       
CONECT   21   19    8    8   47                                       
CONECT   22   13   48                                                 
CONECT   23   26   49                                                 
CONECT   24   25   12   26   26                                       
CONECT   25   10   10   24   50                                       
CONECT   26   24   24   13   23                                       
CONECT   27   14   14   11   51                                       
CONECT   28   30   15   15   14                                       
CONECT   29   15   11   11   52                                       
CONECT   30   28                                                      
CONECT   31   12   12                                                 
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
