COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.257  -1.078  -0.235  1.00  0.00           C  
HETATM    2  N   UNL     1       2.291   0.960  -0.449  1.00  0.00           N  
HETATM    3  C   UNL     1       5.996  -1.673   0.651  1.00  0.00           C  
HETATM    4  C   UNL     1       4.585  -1.145   0.920  1.00  0.00           C  
HETATM    5  C   UNL     1       4.795   0.488  -0.858  1.00  0.00           C  
HETATM    6  C   UNL     1       6.213   0.008  -1.181  1.00  0.00           C  
HETATM    7  C   UNL     1       6.862  -0.540   0.093  1.00  0.00           C  
HETATM    8  N   UNL     1       0.501  -0.871   0.529  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.747   2.910  -0.389  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.733  -0.793   2.459  1.00  0.00           C  
HETATM   11  C   UNL     1       0.567   2.612  -0.587  1.00  0.00           C  
HETATM   12  C   UNL     1       2.680  -0.265  -0.148  1.00  0.00           C  
HETATM   13  C   UNL     1       1.759  -1.200   0.352  1.00  0.00           C  
HETATM   14  C   UNL     1       0.085   0.367   0.230  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.944   0.747   0.797  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.238   0.452   2.122  1.00  0.00           C  
HETATM   17  C   UNL     1       1.013   1.310  -0.275  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.936  -1.747   1.479  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.645  -1.458   0.157  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.149  -0.214  -0.187  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.617   1.931   0.115  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.193   0.717   0.404  1.00  0.00           N  
HETATM   23  N   UNL     1       4.007  -0.632  -0.329  1.00  0.00           N  
HETATM   24  N   UNL     1       6.972   0.532   1.091  1.00  0.00           N  
HETATM   25  S   UNL     1      -3.314   2.334   0.364  1.00  0.00           S  
HETATM   26 CL   UNL     1      -3.785   0.149  -1.845  1.00  0.00          Cl  
HETATM   27 CL   UNL     1      -4.901  -2.659  -1.070  1.00  0.00          Cl  
HETATM   28  H   UNL     1       8.871  -0.273  -0.638  1.00  0.00           H  
HETATM   29  H   UNL     1       8.719  -1.468   0.672  1.00  0.00           H  
HETATM   30  H   UNL     1       8.175  -1.876  -0.973  1.00  0.00           H  
HETATM   31  H   UNL     1       6.431  -2.039   1.582  1.00  0.00           H  
HETATM   32  H   UNL     1       5.949  -2.486  -0.073  1.00  0.00           H  
HETATM   33  H   UNL     1       3.962  -1.953   1.304  1.00  0.00           H  
HETATM   34  H   UNL     1       4.632  -0.341   1.655  1.00  0.00           H  
HETATM   35  H   UNL     1       4.841   1.283  -0.115  1.00  0.00           H  
HETATM   36  H   UNL     1       4.325   0.866  -1.766  1.00  0.00           H  
HETATM   37  H   UNL     1       6.169  -0.778  -1.934  1.00  0.00           H  
HETATM   38  H   UNL     1       6.802   0.843  -1.559  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.118   3.898  -0.620  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.956  -1.023   3.490  1.00  0.00           H  
HETATM   41  H   UNL     1       1.250   3.352  -0.975  1.00  0.00           H  
HETATM   42  H   UNL     1       2.089  -2.199   0.594  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.080   1.196   2.889  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.323  -2.719   1.746  1.00  0.00           H  
HETATM   45  H   UNL     1       7.395   0.193   1.941  1.00  0.00           H  
HETATM   46  H   UNL     1       7.483   1.319   0.721  1.00  0.00           H  
CONECT    1    7   28   29   30                                       
CONECT    2   12   17   17                                            
CONECT    3    7    4   31   32                                       
CONECT    4   23    3   33   34                                       
CONECT    5    6   23   35   36                                       
CONECT    6    5    7   37   38                                       
CONECT    7    1    6   24    3                                       
CONECT    8   13   14   14                                            
CONECT    9   11   11   21   39                                       
CONECT   10   18   18   16   40                                       
CONECT   11   17    9    9   41                                       
CONECT   12   23   13   13    2                                       
CONECT   13   12   12    8   42                                       
CONECT   14    8    8   17   22                                       
CONECT   15   16   16   20   25                                       
CONECT   16   10   15   15   43                                       
CONECT   17    2    2   14   11                                       
CONECT   18   10   10   19   44                                       
CONECT   19   18   20   20   27                                       
CONECT   20   19   19   15   26                                       
CONECT   21   22   22    9   25                                       
CONECT   22   14   21   21                                            
CONECT   23    5    4   12                                            
CONECT   24    7   45   46                                            
CONECT   25   21   15                                                 
CONECT   26   20                                                      
CONECT   27   19                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
