COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.661   0.451  -0.381  1.00  0.00           N  
HETATM    2  C   UNL     1      -2.672  -0.689  -2.836  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.109  -1.648  -1.780  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.443  -0.815  -0.682  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.131  -1.711   0.518  1.00  0.00           C  
HETATM    6  C   UNL     1       0.051  -3.795   0.961  1.00  0.00           C  
HETATM    7  C   UNL     1       1.232  -5.871   1.391  1.00  0.00           C  
HETATM    8  C   UNL     1       2.093   1.206  -2.171  1.00  0.00           C  
HETATM    9  C   UNL     1       4.228   1.499  -0.479  1.00  0.00           C  
HETATM   10  C   UNL     1       5.182   1.378   1.709  1.00  0.00           C  
HETATM   11  C   UNL     1       2.992   1.042   0.047  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.369   0.294  -0.253  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.137   0.926   0.957  1.00  0.00           C  
HETATM   14  O   UNL     1       0.129  -0.350  -2.381  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.162  -0.222  -1.210  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.705   0.091  -2.232  1.00  0.00           O  
HETATM   17  N   UNL     1      -0.267  -2.815   0.093  1.00  0.00           N  
HETATM   18  C   UNL     1       0.918  -4.904   0.534  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.379  -3.763   2.098  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.437   0.687  -1.041  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.267   1.718  -0.614  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.031   2.345   0.593  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.965   1.949   1.380  1.00  0.00           C  
HETATM   24 CL   UNL     1      -2.667   2.735   2.899  1.00  0.00          Cl  
HETATM   25  C   UNL     1       1.903   0.897  -0.840  1.00  0.00           C  
HETATM   26  C   UNL     1       2.883   0.760   1.414  1.00  0.00           C  
HETATM   27  C   UNL     1       3.967   0.929   2.223  1.00  0.00           C  
HETATM   28  C   UNL     1       5.323   1.662   0.385  1.00  0.00           C  
HETATM   29  C   UNL     1       4.316   1.776  -1.852  1.00  0.00           C  
HETATM   30  N   UNL     1       3.265   1.626  -2.625  1.00  0.00           N  
HETATM   31  H   UNL     1       0.390   0.628   0.533  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.880  -0.032  -3.196  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.083  -1.260  -3.670  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.918  -2.240  -1.352  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.373  -2.309  -2.238  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.623  -1.127   1.286  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.060  -2.112   0.923  1.00  0.00           H  
HETATM   38  H   UNL     1       0.850  -5.843   2.401  1.00  0.00           H  
HETATM   39  H   UNL     1       1.869  -6.685   1.077  1.00  0.00           H  
HETATM   40  H   UNL     1       1.269   1.100  -2.860  1.00  0.00           H  
HETATM   41  H   UNL     1       6.025   1.504   2.372  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.306   0.617   1.573  1.00  0.00           H  
HETATM   43  H   UNL     1       0.076  -2.840  -0.814  1.00  0.00           H  
HETATM   44  H   UNL     1       1.300  -4.932  -0.476  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.099   2.029  -1.228  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.678   3.145   0.922  1.00  0.00           H  
HETATM   47  H   UNL     1       1.947   0.411   1.825  1.00  0.00           H  
HETATM   48  H   UNL     1       3.883   0.711   3.277  1.00  0.00           H  
HETATM   49  H   UNL     1       6.271   2.009   0.001  1.00  0.00           H  
HETATM   50  H   UNL     1       5.247   2.125  -2.273  1.00  0.00           H  
CONECT    1   25   15   31                                            
CONECT    2    3   16   32   33                                       
CONECT    3    4    2   34   35                                       
CONECT    4    5   15    3   12                                       
CONECT    5   17    4   36   37                                       
CONECT    6   19   19   18   17                                       
CONECT    7   18   18   38   39                                       
CONECT    8   30   30   25   40                                       
CONECT    9   28   29   29   11                                       
CONECT   10   28   28   27   41                                       
CONECT   11    9   26   25   25                                       
CONECT   12    4   13   13   20                                       
CONECT   13   12   12   23   42                                       
CONECT   14   15   15                                                 
CONECT   15    1    4   14   14                                       
CONECT   16    2   20                                                 
CONECT   17    6    5   43                                            
CONECT   18    7    7    6   44                                       
CONECT   19    6    6                                                 
CONECT   20   12   16   21   21                                       
CONECT   21   20   20   22   45                                       
CONECT   22   23   23   21   46                                       
CONECT   23   13   24   22   22                                       
CONECT   24   23                                                      
CONECT   25   11   11    8    1                                       
CONECT   26   27   27   11   47                                       
CONECT   27   10   26   26   48                                       
CONECT   28   10   10    9   49                                       
CONECT   29    9    9   30   50                                       
CONECT   30   29    8    8                                            
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
