COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.128  -0.588  -1.164  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.323   0.162   1.798  1.00  0.00           C  
HETATM    3  C   UNL     1       5.139  -2.874   0.399  1.00  0.00           C  
HETATM    4  C   UNL     1       5.262  -1.633   0.994  1.00  0.00           C  
HETATM    5  C   UNL     1       1.928   1.587   0.866  1.00  0.00           C  
HETATM    6  C   UNL     1       5.251  -0.486   0.214  1.00  0.00           C  
HETATM    7  C   UNL     1       4.228   1.460   0.979  1.00  0.00           C  
HETATM    8  C   UNL     1       0.615   0.927   0.528  1.00  0.00           C  
HETATM    9  C   UNL     1       5.011  -1.830  -1.757  1.00  0.00           C  
HETATM   10  F   UNL     1       4.902  -4.188  -1.558  1.00  0.00           F  
HETATM   11  C   UNL     1       5.016  -2.974  -0.977  1.00  0.00           C  
HETATM   12  O   UNL     1       5.361   0.736   0.799  1.00  0.00           O  
HETATM   13  N   UNL     1       3.053   0.919   0.701  1.00  0.00           N  
HETATM   14  N   UNL     1      -0.286   1.012   1.678  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.472  -0.943   0.847  1.00  0.00           C  
HETATM   16  S   UNL     1      -2.986  -1.839   0.758  1.00  0.00           S  
HETATM   17  C   UNL     1      -4.120  -0.642   0.137  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.473  -0.948   0.040  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.359  -0.005  -0.447  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.900   1.240  -0.837  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.555   1.547  -0.742  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.664   0.613  -0.251  1.00  0.00           C  
HETATM   23 CL   UNL     1      -6.048  -2.511   0.530  1.00  0.00          Cl  
HETATM   24  C   UNL     1      -0.442  -1.268   0.041  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.582  -2.260  -0.867  1.00  0.00           O  
HETATM   26  C   UNL     1       0.864  -0.526   0.152  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.131   0.308   2.696  1.00  0.00           O  
HETATM   28  C   UNL     1      -0.018   1.643  -0.637  1.00  0.00           C  
HETATM   29  C   UNL     1       0.210   1.293  -1.904  1.00  0.00           C  
HETATM   30  S   UNL     1      -0.695   2.350  -2.980  1.00  0.00           S  
HETATM   31  C   UNL     1      -1.352   3.233  -1.608  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.885   2.710  -0.473  1.00  0.00           C  
HETATM   33  C   UNL     1       1.937   2.885   1.338  1.00  0.00           C  
HETATM   34  C   UNL     1       3.149   3.486   1.647  1.00  0.00           C  
HETATM   35  C   UNL     1       4.312   2.758   1.468  1.00  0.00           C  
HETATM   36  H   UNL     1       5.119   0.305  -1.773  1.00  0.00           H  
HETATM   37  H   UNL     1       5.147  -3.767   1.006  1.00  0.00           H  
HETATM   38  H   UNL     1       5.366  -1.557   2.066  1.00  0.00           H  
HETATM   39  H   UNL     1       4.915  -1.909  -2.830  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.135   1.686   2.359  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.410  -0.242  -0.522  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.595   1.974  -1.218  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.202   2.521  -1.044  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.614   0.853  -0.177  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.477  -2.622  -0.920  1.00  0.00           H  
HETATM   46  H   UNL     1       1.390  -0.567  -0.802  1.00  0.00           H  
HETATM   47  H   UNL     1       1.475  -0.999   0.921  1.00  0.00           H  
HETATM   48  H   UNL     1       0.853   0.485  -2.220  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.034   4.068  -1.674  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.156   3.095   0.499  1.00  0.00           H  
HETATM   51  H   UNL     1       1.011   3.425   1.466  1.00  0.00           H  
HETATM   52  H   UNL     1       3.184   4.500   2.017  1.00  0.00           H  
HETATM   53  H   UNL     1       5.273   3.196   1.694  1.00  0.00           H  
CONECT    1    9    9    6   36                                       
CONECT    2   14   15   27   27                                       
CONECT    3   11   11    4   37                                       
CONECT    4    3    6    6   38                                       
CONECT    5   13   13   33    8                                       
CONECT    6    4    4    1   12                                       
CONECT    7   12   35   35   13                                       
CONECT    8    5   28   26   14                                       
CONECT    9   11    1    1   39                                       
CONECT   10   11                                                      
CONECT   11   10    3    3    9                                       
CONECT   12    6    7                                                 
CONECT   13    7    5    5                                            
CONECT   14    8    2   40                                            
CONECT   15   24   24    2   16                                       
CONECT   16   15   17                                                 
CONECT   17   22   16   18   18                                       
CONECT   18   17   17   19   23                                       
CONECT   19   20   20   18   41                                       
CONECT   20   21   19   19   42                                       
CONECT   21   22   22   20   43                                       
CONECT   22   21   21   17   44                                       
CONECT   23   18                                                      
CONECT   24   26   25   15   15                                       
CONECT   25   24   45                                                 
CONECT   26    8   24   46   47                                       
CONECT   27    2    2                                                 
CONECT   28   29   29   32    8                                       
CONECT   29   30   28   28   48                                       
CONECT   30   31   29                                                 
CONECT   31   30   32   32   49                                       
CONECT   32   31   31   28   50                                       
CONECT   33   34   34    5   51                                       
CONECT   34   35   33   33   52                                       
CONECT   35    7    7   34   53                                       
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    9                                                      
CONECT   40   14                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
CONECT   49   31                                                      
CONECT   50   32                                                      
CONECT   51   33                                                      
CONECT   52   34                                                      
CONECT   53   35                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
