COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.053  -0.840   1.739  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.503   0.227   0.775  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.744   0.868   0.781  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.700   1.760  -0.278  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.765   2.681  -0.701  1.00  0.00           C  
HETATM    6  C   UNL     1       2.158  -1.102  -0.213  1.00  0.00           C  
HETATM    7  C   UNL     1       3.297  -1.469  -0.800  1.00  0.00           C  
HETATM    8  C   UNL     1       5.694  -0.576  -1.188  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.410  -3.112   0.722  1.00  0.00           C  
HETATM   10  C   UNL     1       6.568   0.446  -0.978  1.00  0.00           C  
HETATM   11  C   UNL     1       6.180   1.574  -0.269  1.00  0.00           C  
HETATM   12  C   UNL     1       4.901   1.672   0.230  1.00  0.00           C  
HETATM   13  C   UNL     1       4.374  -0.503  -0.688  1.00  0.00           C  
HETATM   14  C   UNL     1       3.984   0.635   0.026  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.713  -4.018   0.018  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.216  -3.935  -0.816  1.00  0.00           C  
HETATM   17  C   UNL     1       0.913  -3.171  -0.826  1.00  0.00           C  
HETATM   18  C   UNL     1       0.927  -1.920  -0.196  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.212  -1.443   0.446  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.366  -2.214   0.461  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.369  -3.470  -0.176  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.624  -2.025   0.991  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.468   1.612  -0.851  1.00  0.00           N  
HETATM   24  N   UNL     1      -2.800   0.720  -0.212  1.00  0.00           N  
HETATM   25  O   UNL     1      -5.573   3.493  -1.760  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.819   2.709  -0.097  1.00  0.00           O  
HETATM   27  S   UNL     1       2.310   0.473   0.541  1.00  0.00           S  
HETATM   28 CL   UNL     1       4.423   3.086   1.116  1.00  0.00          Cl  
HETATM   29  H   UNL     1      -2.219  -0.465   2.333  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.878  -1.106   2.399  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.563   0.704   1.465  1.00  0.00           H  
HETATM   32  H   UNL     1       3.409  -2.411  -1.316  1.00  0.00           H  
HETATM   33  H   UNL     1       6.010  -1.447  -1.742  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.440  -3.223   1.027  1.00  0.00           H  
HETATM   35  H   UNL     1       7.574   0.377  -1.366  1.00  0.00           H  
HETATM   36  H   UNL     1       6.883   2.378  -0.108  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.075  -4.971  -0.338  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.221  -4.899  -1.304  1.00  0.00           H  
HETATM   39  H   UNL     1       1.801  -3.533  -1.321  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.198  -0.478   0.931  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.146   2.108  -1.620  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.302   4.081  -2.000  1.00  0.00           H  
CONECT    1    2   22   29   30                                       
CONECT    2   24   24    3    1                                       
CONECT    3    4    4    2   31                                       
CONECT    4    5   23    3    3                                       
CONECT    5   26   26   25    4                                       
CONECT    6    7    7   27   18                                       
CONECT    7   13    6    6   32                                       
CONECT    8   10   13   13   33                                       
CONECT    9   22   15   15   34                                       
CONECT   10   11   11    8   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12   11   28   14   14                                       
CONECT   13    8    8   14    7                                       
CONECT   14   12   12   13   27                                       
CONECT   15   21    9    9   37                                       
CONECT   16   17   17   21   38                                       
CONECT   17   18   16   16   39                                       
CONECT   18    6   19   19   17                                       
CONECT   19   18   18   20   40                                       
CONECT   20   19   21   21   22                                       
CONECT   21   20   20   16   15                                       
CONECT   22   20    1    9                                            
CONECT   23    4   24   41                                            
CONECT   24   23    2    2                                            
CONECT   25    5   42                                                 
CONECT   26    5    5                                                 
CONECT   27   14    6                                                 
CONECT   28   12                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
