COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.418   1.060   1.862  1.00  0.00           C  
HETATM    2  C   UNL     1       2.887   0.311   0.801  1.00  0.00           C  
HETATM    3  C   UNL     1       3.267   0.603  -0.512  1.00  0.00           C  
HETATM    4  C   UNL     1       4.158   1.622  -0.760  1.00  0.00           C  
HETATM    5  C   UNL     1       1.934  -0.780   1.071  1.00  0.00           C  
HETATM    6  N   UNL     1       1.972  -1.906   0.330  1.00  0.00           N  
HETATM    7  C   UNL     1       2.977  -2.223  -0.700  1.00  0.00           C  
HETATM    8  C   UNL     1       1.472  -4.093  -0.595  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.366  -2.544   0.074  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.911  -1.675  -0.569  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.298  -1.196  -0.915  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.737   2.418  -0.504  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.035   0.386  -0.279  1.00  0.00           C  
HETATM   14  O   UNL     1       5.562   3.369   0.042  1.00  0.00           O  
HETATM   15  C   UNL     1       4.683   2.365   0.294  1.00  0.00           C  
HETATM   16  C   UNL     1       4.313   2.083   1.601  1.00  0.00           C  
HETATM   17  O   UNL     1       3.050   0.787   3.139  1.00  0.00           O  
HETATM   18 CL   UNL     1       4.628   1.983  -2.391  1.00  0.00          Cl  
HETATM   19  O   UNL     1       1.114  -0.665   1.961  1.00  0.00           O  
HETATM   20  C   UNL     1       2.977  -3.770  -0.791  1.00  0.00           C  
HETATM   21  C   UNL     1       1.020  -3.023   0.421  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.550  -1.651  -0.965  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.822  -1.216  -1.286  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.601   0.020  -0.150  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.841   1.177  -0.670  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.054   1.887   0.108  1.00  0.00           C  
HETATM   27  F   UNL     1      -7.159   2.533  -0.456  1.00  0.00           F  
HETATM   28  F   UNL     1      -6.050   2.039   1.499  1.00  0.00           F  
HETATM   29  C   UNL     1      -2.727  -2.564   0.474  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.455  -3.003   0.792  1.00  0.00           C  
HETATM   31  H   UNL     1       2.862   0.028  -1.332  1.00  0.00           H  
HETATM   32  H   UNL     1       2.691  -1.787  -1.657  1.00  0.00           H  
HETATM   33  H   UNL     1       3.959  -1.862  -0.396  1.00  0.00           H  
HETATM   34  H   UNL     1       0.930  -3.991  -1.535  1.00  0.00           H  
HETATM   35  H   UNL     1       1.342  -5.094  -0.184  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.350  -0.977  -1.982  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.022  -1.972  -0.667  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.269   3.136   0.170  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.930   2.878  -1.474  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.376   0.250  -1.305  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.645  -0.199   0.409  1.00  0.00           H  
HETATM   42  H   UNL     1       5.145   4.230  -0.098  1.00  0.00           H  
HETATM   43  H   UNL     1       4.723   2.662   2.415  1.00  0.00           H  
HETATM   44  H   UNL     1       3.613   0.135   3.579  1.00  0.00           H  
HETATM   45  H   UNL     1       3.324  -4.104  -1.769  1.00  0.00           H  
HETATM   46  H   UNL     1       3.577  -4.208   0.006  1.00  0.00           H  
HETATM   47  H   UNL     1       1.028  -3.436   1.429  1.00  0.00           H  
HETATM   48  H   UNL     1       0.301  -1.292  -1.525  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.965  -0.518  -2.098  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.608   1.025  -1.724  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.921   1.304  -0.098  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.577  -2.915   1.041  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.313  -3.704   1.600  1.00  0.00           H  
CONECT    1   17   16   16    2                                       
CONECT    2    1    5    3    3                                       
CONECT    3    2    2    4   31                                       
CONECT    4   15   15    3   18                                       
CONECT    5   19   19    2    6                                       
CONECT    6    5    7   21                                            
CONECT    7    6   20   32   33                                       
CONECT    8   21   20   34   35                                       
CONECT    9   21   22   22   30                                       
CONECT   10   23   23   29   11                                       
CONECT   11   10   24   36   37                                       
CONECT   12   25   26   38   39                                       
CONECT   13   24   26   40   41                                       
CONECT   14   15   42                                                 
CONECT   15   16   14    4    4                                       
CONECT   16    1    1   15   43                                       
CONECT   17    1   44                                                 
CONECT   18    4                                                      
CONECT   19    5    5                                                 
CONECT   20    7    8   45   46                                       
CONECT   21    6    9    8   47                                       
CONECT   22    9    9   23   48                                       
CONECT   23   22   10   10   49                                       
CONECT   24   25   11   13                                            
CONECT   25   12   24   50   51                                       
CONECT   26   12   28   27   13                                       
CONECT   27   26                                                      
CONECT   28   26                                                      
CONECT   29   30   30   10   52                                       
CONECT   30    9   29   29   53                                       
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
