COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.868  -1.996   2.524  1.00  0.00           C  
HETATM    2  C   UNL     1       6.975  -1.354   0.217  1.00  0.00           C  
HETATM    3  C   UNL     1       4.795   0.761  -1.293  1.00  0.00           C  
HETATM    4  C   UNL     1       3.350   1.094  -1.013  1.00  0.00           C  
HETATM    5  C   UNL     1       2.615   2.254  -1.119  1.00  0.00           C  
HETATM    6  C   UNL     1       0.662   1.087  -0.337  1.00  0.00           C  
HETATM    7  C   UNL     1       1.400  -0.087  -0.228  1.00  0.00           C  
HETATM    8  C   UNL     1       2.752  -0.088  -0.568  1.00  0.00           C  
HETATM    9  C   UNL     1       3.776  -1.151  -0.560  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.777   1.094   0.024  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.590  -1.087  -0.168  1.00  0.00           N  
HETATM   12  C   UNL     1      -5.013  -1.104   0.179  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.314  -0.558  -0.618  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.980  -2.562   0.660  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.476  -2.550   0.375  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.701   2.179   0.938  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.354   2.219   0.620  1.00  0.00           C  
HETATM   18  O   UNL     1       6.229  -2.007   1.246  1.00  0.00           O  
HETATM   19  C   UNL     1       6.200  -1.428  -1.100  1.00  0.00           C  
HETATM   20  N   UNL     1       4.957  -0.663  -0.978  1.00  0.00           N  
HETATM   21  C   UNL     1       1.274   2.258  -0.783  1.00  0.00           C  
HETATM   22  O   UNL     1       3.580  -2.302  -0.223  1.00  0.00           O  
HETATM   23  N   UNL     1      -1.540   0.031  -0.221  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.824   0.035   0.100  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.824  -0.466  -0.953  1.00  0.00           C  
HETATM   26  O   UNL     1      -7.673  -1.928  -0.420  1.00  0.00           O  
HETATM   27  N   UNL     1      -3.397   1.085   0.671  1.00  0.00           N  
HETATM   28 CL   UNL     1      -0.404   3.634   0.953  1.00  0.00          Cl  
HETATM   29  H   UNL     1       6.238  -2.511   3.250  1.00  0.00           H  
HETATM   30  H   UNL     1       7.830  -2.502   2.454  1.00  0.00           H  
HETATM   31  H   UNL     1       7.022  -0.965   2.844  1.00  0.00           H  
HETATM   32  H   UNL     1       7.132  -0.310   0.489  1.00  0.00           H  
HETATM   33  H   UNL     1       7.940  -1.847   0.099  1.00  0.00           H  
HETATM   34  H   UNL     1       5.024   0.941  -2.343  1.00  0.00           H  
HETATM   35  H   UNL     1       5.448   1.361  -0.660  1.00  0.00           H  
HETATM   36  H   UNL     1       3.087   3.162  -1.464  1.00  0.00           H  
HETATM   37  H   UNL     1       0.927  -0.994   0.118  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.184  -1.863  -0.586  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.170  -0.543   1.100  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.518   0.006   0.293  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.899  -0.145  -1.439  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.324  -3.592   0.757  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.179  -2.023   1.586  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.272  -3.124  -0.529  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.943  -2.993   1.216  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.179   3.031   1.399  1.00  0.00           H  
HETATM   47  H   UNL     1       6.807  -1.008  -1.902  1.00  0.00           H  
HETATM   48  H   UNL     1       5.967  -2.468  -1.326  1.00  0.00           H  
HETATM   49  H   UNL     1       0.700   3.169  -0.866  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.539   0.580  -1.061  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.627  -0.996  -1.885  1.00  0.00           H  
CONECT    1   18   29   30   31                                       
CONECT    2   19   18   32   33                                       
CONECT    3    4   20   34   35                                       
CONECT    4    5    3    8    8                                       
CONECT    5   21   21    4   36                                       
CONECT    6   21   10    7    7                                       
CONECT    7    6    6    8   37                                       
CONECT    8    4    4    7    9                                       
CONECT    9    8   20   22   22                                       
CONECT   10   23    6   17   17                                       
CONECT   11   12   24   38                                            
CONECT   12   15   25   11   39                                       
CONECT   13   26   25   40   41                                       
CONECT   14   26   15   42   43                                       
CONECT   15   14   12   44   45                                       
CONECT   16   27   27   17   46                                       
CONECT   17   10   10   16   28                                       
CONECT   18    2    1                                                 
CONECT   19   20    2   47   48                                       
CONECT   20    3    9   19                                            
CONECT   21    5    5    6   49                                       
CONECT   22    9    9                                                 
CONECT   23   24   24   10                                            
CONECT   24   11   23   23   27                                       
CONECT   25   13   12   50   51                                       
CONECT   26   14   13                                                 
CONECT   27   24   16   16                                            
CONECT   28   17                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
