COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.503   4.242  -0.100  1.00  0.00           C  
HETATM    2  C   UNL     1       4.047   2.362  -0.122  1.00  0.00           C  
HETATM    3  C   UNL     1       5.083   1.643  -0.706  1.00  0.00           C  
HETATM    4  C   UNL     1       4.910   0.313  -1.034  1.00  0.00           C  
HETATM    5  C   UNL     1       3.699  -0.315  -0.783  1.00  0.00           C  
HETATM    6  C   UNL     1       2.650   0.405  -0.194  1.00  0.00           C  
HETATM    7  C   UNL     1       2.835   1.747   0.140  1.00  0.00           C  
HETATM    8  C   UNL     1       1.358  -0.256   0.077  1.00  0.00           C  
HETATM    9  C   UNL     1       1.418   0.460   2.484  1.00  0.00           C  
HETATM   10  C   UNL     1       0.884  -0.307   3.719  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.552  -0.675   3.261  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.375  -0.947   1.753  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.228  -2.450   1.508  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.565  -0.418   0.994  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.762   0.739  -0.403  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.274   1.605  -1.373  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.613   1.609  -1.645  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.475   0.758  -0.966  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.992  -0.105  -0.004  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.635  -0.118   0.288  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.934  -1.026   0.729  1.00  0.00           C  
HETATM   22  C   UNL     1       3.903  -3.587  -1.901  1.00  0.00           C  
HETATM   23  C   UNL     1       2.653  -3.580  -1.275  1.00  0.00           C  
HETATM   24  N   UNL     1       0.846  -0.249   1.324  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.515   0.506   0.079  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.847  -0.841   1.161  1.00  0.00           N  
HETATM   27  N   UNL     1       3.525  -1.662  -1.116  1.00  0.00           N  
HETATM   28  N   UNL     1       4.382  -2.372  -1.760  1.00  0.00           N  
HETATM   29  N   UNL     1       2.490  -2.362  -0.812  1.00  0.00           N  
HETATM   30  O   UNL     1       4.227   3.670   0.198  1.00  0.00           O  
HETATM   31  O   UNL     1       0.755  -0.805  -0.824  1.00  0.00           O  
HETATM   32 CL   UNL     1      -7.173   0.782  -1.328  1.00  0.00          Cl  
HETATM   33  H   UNL     1       5.512   5.288   0.205  1.00  0.00           H  
HETATM   34  H   UNL     1       6.279   3.699   0.440  1.00  0.00           H  
HETATM   35  H   UNL     1       5.690   4.174  -1.172  1.00  0.00           H  
HETATM   36  H   UNL     1       6.028   2.126  -0.904  1.00  0.00           H  
HETATM   37  H   UNL     1       5.720  -0.240  -1.488  1.00  0.00           H  
HETATM   38  H   UNL     1       2.033   2.307   0.598  1.00  0.00           H  
HETATM   39  H   UNL     1       1.075   1.494   2.502  1.00  0.00           H  
HETATM   40  H   UNL     1       2.507   0.422   2.454  1.00  0.00           H  
HETATM   41  H   UNL     1       1.476  -1.203   3.908  1.00  0.00           H  
HETATM   42  H   UNL     1       0.862   0.336   4.599  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.903  -1.570   3.776  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.235   0.157   3.429  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.132  -2.962   1.840  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.078  -2.632   0.444  1.00  0.00           H  
HETATM   47  H   UNL     1       0.629  -2.827   2.066  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.612   2.271  -1.907  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.004   2.280  -2.395  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.017  -1.967   0.187  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.549  -1.216   1.731  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.916  -0.559   0.800  1.00  0.00           H  
HETATM   53  H   UNL     1       4.378  -4.421  -2.396  1.00  0.00           H  
HETATM   54  H   UNL     1       1.963  -4.407  -1.190  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.151  -1.525   1.778  1.00  0.00           H  
CONECT    1   30   33   34   35                                       
CONECT    2    3   30    7    7                                       
CONECT    3    4    4    2   36                                       
CONECT    4    3    3    5   37                                       
CONECT    5    4   27    6    6                                       
CONECT    6    5    5    7    8                                       
CONECT    7    2    2    6   38                                       
CONECT    8    6   31   31   24                                       
CONECT    9   24   10   39   40                                       
CONECT   10    9   11   41   42                                       
CONECT   11   12   10   43   44                                       
CONECT   12   13   14   24   11                                       
CONECT   13   12   45   46   47                                       
CONECT   14   25   25   26   12                                       
CONECT   15   16   25   20   20                                       
CONECT   16   17   17   15   48                                       
CONECT   17   16   16   18   49                                       
CONECT   18   17   32   19   19                                       
CONECT   19   18   18   20   21                                       
CONECT   20   15   15   19   26                                       
CONECT   21   19   50   51   52                                       
CONECT   22   23   28   28   53                                       
CONECT   23   29   29   22   54                                       
CONECT   24    8   12    9                                            
CONECT   25   15   14   14                                            
CONECT   26   20   14   55                                            
CONECT   27   29    5   28                                            
CONECT   28   27   22   22                                            
CONECT   29   23   23   27                                            
CONECT   30    1    2                                                 
CONECT   31    8    8                                                 
CONECT   32   18                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   26                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
