COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.704  -1.578  -2.690  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.156  -0.924  -1.420  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.524  -1.824  -0.390  1.00  0.00           C  
HETATM    4  C   UNL     1       0.333  -2.397   1.099  1.00  0.00           C  
HETATM    5  C   UNL     1       1.758  -2.633   0.585  1.00  0.00           C  
HETATM    6  C   UNL     1       1.691  -0.412  -0.626  1.00  0.00           C  
HETATM    7  C   UNL     1       4.878   1.146   1.397  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.803   1.493  -1.503  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.371   1.224   0.759  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.686   0.131   0.257  1.00  0.00           C  
HETATM   11  C   UNL     1       3.547  -0.985   0.863  1.00  0.00           C  
HETATM   12  C   UNL     1       0.265  -0.176  -0.112  1.00  0.00           C  
HETATM   13  C   UNL     1       4.220   0.262   0.463  1.00  0.00           C  
HETATM   14  C   UNL     1       5.411   2.214   0.815  1.00  0.00           C  
HETATM   15  C   UNL     1       4.284   0.700  -0.822  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.902   0.266  -0.873  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.267   2.452   0.131  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.484   2.586  -1.000  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.352  -1.478   0.178  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.421  -0.746  -2.751  1.00  0.00           C  
HETATM   21  O   UNL     1       4.050  -1.704   1.706  1.00  0.00           O  
HETATM   22  N   UNL     1       2.375  -1.331   0.295  1.00  0.00           N  
HETATM   23  O   UNL     1      -2.070  -2.859  -0.072  1.00  0.00           O  
HETATM   24  S   UNL     1       5.132   2.176  -0.917  1.00  0.00           S  
HETATM   25 CL   UNL     1      -5.355   1.054   2.179  1.00  0.00          Cl  
HETATM   26  H   UNL     1      -2.607  -2.660  -2.780  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.604  -1.148  -3.130  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.204  -3.344   1.137  1.00  0.00           H  
HETATM   29  H   UNL     1       0.372  -1.955   2.095  1.00  0.00           H  
HETATM   30  H   UNL     1       2.341  -3.152   1.346  1.00  0.00           H  
HETATM   31  H   UNL     1       1.725  -3.233  -0.325  1.00  0.00           H  
HETATM   32  H   UNL     1       1.652  -0.854  -1.622  1.00  0.00           H  
HETATM   33  H   UNL     1       2.227   0.536  -0.667  1.00  0.00           H  
HETATM   34  H   UNL     1       4.927   0.960   2.459  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.191   1.599  -2.387  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.766  -0.828   0.747  1.00  0.00           H  
HETATM   37  H   UNL     1       0.299   0.424   0.798  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.316   0.346  -0.872  1.00  0.00           H  
HETATM   39  H   UNL     1       5.942   2.997   1.335  1.00  0.00           H  
HETATM   40  H   UNL     1       3.856   0.183  -1.669  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.802   3.305   0.522  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.402   3.545  -1.490  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.480  -1.281  -2.881  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.477   0.231  -3.231  1.00  0.00           H  
CONECT    1    2   20   26   27                                       
CONECT    2   16    3   20    1                                       
CONECT    3   19   23   23    2                                       
CONECT    4   19    5   28   29                                       
CONECT    5    4   22   30   31                                       
CONECT    6   12   22   32   33                                       
CONECT    7   14   14   13   34                                       
CONECT    8   18   18   16   35                                       
CONECT    9   25   17   17   10                                       
CONECT   10    9   16   16   36                                       
CONECT   11   13   22   21   21                                       
CONECT   12   19    6   37   38                                       
CONECT   13   15   15    7   11                                       
CONECT   14   24    7    7   39                                       
CONECT   15   24   13   13   40                                       
CONECT   16   10   10    8    2                                       
CONECT   17    9    9   18   41                                       
CONECT   18   17    8    8   42                                       
CONECT   19    4   12    3                                            
CONECT   20    2    1   43   44                                       
CONECT   21   11   11                                                 
CONECT   22   11    5    6                                            
CONECT   23    3    3                                                 
CONECT   24   15   14                                                 
CONECT   25    9                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
