COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.401   0.171   0.437  1.00  0.00           C  
HETATM    2  C   UNL     1       0.821   2.017   1.067  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.706   0.240  -0.282  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.230  -1.028   0.024  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.986  -0.171   0.056  1.00  0.00           C  
HETATM    6  C   UNL     1       0.539   1.034  -1.111  1.00  0.00           C  
HETATM    7  C   UNL     1       6.075  -1.046  -1.724  1.00  0.00           C  
HETATM    8  C   UNL     1       6.378  -1.207  -0.233  1.00  0.00           C  
HETATM    9  C   UNL     1       7.739  -1.884  -0.057  1.00  0.00           C  
HETATM   10  C   UNL     1       5.292  -2.061   0.425  1.00  0.00           C  
HETATM   11  C   UNL     1       3.962  -1.367   0.301  1.00  0.00           C  
HETATM   12  C   UNL     1       3.880  -0.014   0.258  1.00  0.00           C  
HETATM   13  C   UNL     1       5.035   0.798   0.323  1.00  0.00           C  
HETATM   14  C   UNL     1       2.547   0.629   0.141  1.00  0.00           C  
HETATM   15  C   UNL     1       2.059   1.420   1.179  1.00  0.00           C  
HETATM   16  C   UNL     1       0.058   1.826  -0.077  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.257   1.622  -0.134  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.454   1.111  -0.246  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.841   1.296  -0.419  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.878  -1.233   0.192  1.00  0.00           C  
HETATM   21  C   UNL     1       1.777   0.435  -1.004  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.464   2.023  -0.332  1.00  0.00           N  
HETATM   23  O   UNL     1       2.836  -2.101   0.231  1.00  0.00           O  
HETATM   24  O   UNL     1       4.926   2.007   0.287  1.00  0.00           O  
HETATM   25  O   UNL     1      -1.162   2.415  -0.185  1.00  0.00           O  
HETATM   26  S   UNL     1      -2.233  -0.101   0.214  1.00  0.00           S  
HETATM   27 CL   UNL     1      -7.337  -2.354   0.195  1.00  0.00          Cl  
HETATM   28  H   UNL     1       6.664   0.060   1.489  1.00  0.00           H  
HETATM   29  H   UNL     1       7.136   0.805  -0.058  1.00  0.00           H  
HETATM   30  H   UNL     1       0.442   2.629   1.872  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.766   0.395  -0.417  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.056   0.887  -2.000  1.00  0.00           H  
HETATM   33  H   UNL     1       6.055  -2.027  -2.198  1.00  0.00           H  
HETATM   34  H   UNL     1       5.105  -0.564  -1.847  1.00  0.00           H  
HETATM   35  H   UNL     1       6.847  -0.433  -2.188  1.00  0.00           H  
HETATM   36  H   UNL     1       7.952  -2.001   1.005  1.00  0.00           H  
HETATM   37  H   UNL     1       7.721  -2.864  -0.534  1.00  0.00           H  
HETATM   38  H   UNL     1       8.513  -1.270  -0.517  1.00  0.00           H  
HETATM   39  H   UNL     1       5.243  -3.031  -0.070  1.00  0.00           H  
HETATM   40  H   UNL     1       5.530  -2.204   1.479  1.00  0.00           H  
HETATM   41  H   UNL     1       2.651   1.566   2.071  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.226   2.276  -0.661  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.508  -2.219   0.431  1.00  0.00           H  
HETATM   44  H   UNL     1       2.151  -0.181  -1.809  1.00  0.00           H  
HETATM   45  H   UNL     1       2.001  -1.619   0.152  1.00  0.00           H  
CONECT    1   13    8   28   29                                       
CONECT    2   16   15   15   30                                       
CONECT    3    4    4   19   31                                       
CONECT    4   27    3    3   20                                       
CONECT    5   20   20   18   26                                       
CONECT    6   16   16   21   32                                       
CONECT    7    8   33   34   35                                       
CONECT    8   10    9    1    7                                       
CONECT    9    8   36   37   38                                       
CONECT   10   11    8   39   40                                       
CONECT   11   23   12   12   10                                       
CONECT   12   14   11   11   13                                       
CONECT   13   12   24   24    1                                       
CONECT   14   21   21   15   12                                       
CONECT   15    2    2   14   41                                       
CONECT   16   25    6    6    2                                       
CONECT   17   22   22   26   25                                       
CONECT   18   19   19    5   22                                       
CONECT   19    3   18   18   42                                       
CONECT   20    4    5    5   43                                       
CONECT   21    6   14   14   44                                       
CONECT   22   18   17   17                                            
CONECT   23   11   45                                                 
CONECT   24   13   13                                                 
CONECT   25   17   16                                                 
CONECT   26    5   17                                                 
CONECT   27    4                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   15                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
