COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.754  -0.861  -0.301  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.801   1.344   0.095  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.124   2.750  -0.116  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.804   2.209   1.199  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.516   0.965  -0.764  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.124   2.413  -0.911  1.00  0.00           C  
HETATM    7  C   UNL     1       1.080   2.731  -1.801  1.00  0.00           C  
HETATM    8  C   UNL     1       1.199   2.853  -0.281  1.00  0.00           C  
HETATM    9  C   UNL     1       0.271  -0.086  -1.063  1.00  0.00           C  
HETATM   10  C   UNL     1       2.894  -0.009  -0.214  1.00  0.00           C  
HETATM   11  C   UNL     1       2.277  -0.051   1.030  1.00  0.00           C  
HETATM   12 CL   UNL     1      -3.631  -4.321   0.396  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -2.432  -3.148  -0.054  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.716  -1.802   0.059  1.00  0.00           C  
HETATM   15  F   UNL     1      -3.921  -1.399   0.517  1.00  0.00           F  
HETATM   16  C   UNL     1      -1.195  -3.573  -0.523  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.239  -2.665  -0.880  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.504  -1.299  -0.775  1.00  0.00           C  
HETATM   19  S   UNL     1       1.920  -0.019  -1.682  1.00  0.00           S  
HETATM   20  C   UNL     1       4.281   0.046  -0.300  1.00  0.00           C  
HETATM   21  F   UNL     1       4.884   0.093  -1.508  1.00  0.00           F  
HETATM   22  C   UNL     1       5.047   0.054   0.868  1.00  0.00           C  
HETATM   23  C   UNL     1       6.519   0.113   0.788  1.00  0.00           C  
HETATM   24  O   UNL     1       7.068   0.155  -0.296  1.00  0.00           O  
HETATM   25  O   UNL     1       7.256   0.120   1.916  1.00  0.00           O  
HETATM   26  C   UNL     1       4.413   0.005   2.113  1.00  0.00           C  
HETATM   27  C   UNL     1       3.037  -0.044   2.185  1.00  0.00           C  
HETATM   28  N   UNL     1      -1.735   0.518  -0.308  1.00  0.00           N  
HETATM   29  N   UNL     1      -3.969   2.802   1.254  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.751   2.339   0.188  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.011   1.441  -0.513  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.007   2.530   1.113  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.135   3.806  -0.387  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.504   2.158  -0.948  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.985   2.359   1.887  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.947   3.126  -0.904  1.00  0.00           H  
HETATM   37  H   UNL     1       1.587   1.894  -2.280  1.00  0.00           H  
HETATM   38  H   UNL     1       1.047   3.654  -2.380  1.00  0.00           H  
HETATM   39  H   UNL     1       1.245   3.857   0.141  1.00  0.00           H  
HETATM   40  H   UNL     1       1.785   2.097   0.241  1.00  0.00           H  
HETATM   41  H   UNL     1       1.200  -0.089   1.095  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.988  -4.630  -0.605  1.00  0.00           H  
HETATM   43  H   UNL     1       0.720  -3.004  -1.244  1.00  0.00           H  
HETATM   44  H   UNL     1       8.217   0.159   1.813  1.00  0.00           H  
HETATM   45  H   UNL     1       5.002   0.010   3.019  1.00  0.00           H  
HETATM   46  H   UNL     1       2.550  -0.081   3.149  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.328   0.903  -1.393  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.996   1.474   1.384  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.626   3.122   1.945  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.028   2.836   0.887  1.00  0.00           H  
CONECT    1   18   28   14   14                                       
CONECT    2   28    4   31   31                                       
CONECT    3   30   32   33   34                                       
CONECT    4    2   29   29   35                                       
CONECT    5    6    9    9   28                                       
CONECT    6    8    5    7   36                                       
CONECT    7    6    8   37   38                                       
CONECT    8    6    7   39   40                                       
CONECT    9   19    5    5   18                                       
CONECT   10   20   20   11   19                                       
CONECT   11   27   27   10   41                                       
CONECT   12   13                                                      
CONECT   13   16   16   14   12                                       
CONECT   14    1    1   13   15                                       
CONECT   15   14                                                      
CONECT   16   17   13   13   42                                       
CONECT   17   18   18   16   43                                       
CONECT   18    9   17   17    1                                       
CONECT   19   10    9                                                 
CONECT   20   22   21   10   10                                       
CONECT   21   20                                                      
CONECT   22   23   26   26   20                                       
CONECT   23   24   24   25   22                                       
CONECT   24   23   23                                                 
CONECT   25   23   44                                                 
CONECT   26   22   22   27   45                                       
CONECT   27   26   11   11   46                                       
CONECT   28    5    1    2                                            
CONECT   29    4    4   30                                            
CONECT   30   29   31    3                                            
CONECT   31    2    2   30   47                                       
CONECT   32    3   48   49   50                                       
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   31                                                      
CONECT   48   32                                                      
CONECT   49   32                                                      
CONECT   50   32                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
