COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.080  -1.960  -2.129  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.118  -2.647  -0.306  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.393   1.096   2.125  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.634  -0.025  -0.685  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.445   1.261  -0.866  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.525   2.468  -0.659  1.00  0.00           C  
HETATM    7  C   UNL     1       0.917   1.439  -0.512  1.00  0.00           C  
HETATM    8  C   UNL     1       5.379   0.082   0.589  1.00  0.00           C  
HETATM    9  C   UNL     1       4.498   1.032  -0.122  1.00  0.00           C  
HETATM   10  C   UNL     1       3.101   0.904  -0.066  1.00  0.00           C  
HETATM   11  C   UNL     1       0.955   0.351   0.275  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.249   0.086   2.018  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.998  -0.032   0.707  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.893   2.390   0.732  1.00  0.00           C  
HETATM   15  C   UNL     1       2.305   1.836  -0.761  1.00  0.00           C  
HETATM   16  C   UNL     1       4.175   2.960  -1.520  1.00  0.00           C  
HETATM   17  C   UNL     1       5.030   2.088  -0.867  1.00  0.00           C  
HETATM   18  N   UNL     1       2.254   0.019   0.549  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.127   1.142   0.854  1.00  0.00           N  
HETATM   20  N   UNL     1       2.868   2.818  -1.454  1.00  0.00           N  
HETATM   21  O   UNL     1       4.897  -0.828   1.233  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.311   0.532   1.036  1.00  0.00           O  
HETATM   23  O   UNL     1       6.716   0.225   0.522  1.00  0.00           O  
HETATM   24  C   UNL     1      -0.253  -0.394   0.780  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.699  -1.392  -0.258  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.676  -1.047  -1.173  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.508  -3.218  -2.170  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.527  -3.562  -1.259  1.00  0.00           C  
HETATM   29 CL   UNL     1       1.114  -3.077   0.839  1.00  0.00          Cl  
HETATM   30  H   UNL     1      -2.846  -1.692  -2.841  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.070   0.795   2.925  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.987   2.083   2.346  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.292  -0.888  -0.789  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.851  -0.071  -1.443  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.863   1.290  -1.872  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.252   1.288  -0.134  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.741   2.461  -1.416  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.106   3.386  -0.744  1.00  0.00           H  
HETATM   39  H   UNL     1       0.031   1.925  -0.893  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.750  -0.002   2.983  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.648  -0.885   1.724  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.781   0.000   1.464  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.408  -0.940   0.832  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.227   3.240   0.877  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.678   2.410   1.489  1.00  0.00           H  
HETATM   46  H   UNL     1       4.589   3.774  -2.095  1.00  0.00           H  
HETATM   47  H   UNL     1       6.099   2.223  -0.933  1.00  0.00           H  
HETATM   48  H   UNL     1       2.533  -0.730   1.098  1.00  0.00           H  
HETATM   49  H   UNL     1       7.252  -0.421   1.003  1.00  0.00           H  
HETATM   50  H   UNL     1       0.002  -0.918   1.702  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.122  -0.065  -1.142  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.828  -3.933  -2.914  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.074  -4.541  -1.297  1.00  0.00           H  
CONECT    1   26   26   27   30                                       
CONECT    2   25   25   28   29                                       
CONECT    3   19   12   31   32                                       
CONECT    4    5   13   33   34                                       
CONECT    5    6    4   35   36                                       
CONECT    6   14    5   37   38                                       
CONECT    7   15   11   11   39                                       
CONECT    8    9   21   21   23                                       
CONECT    9   10   10   17    8                                       
CONECT   10   15   18    9    9                                       
CONECT   11    7    7   24   18                                       
CONECT   12    3   22   40   41                                       
CONECT   13    4   19   42   43                                       
CONECT   14    6   19   44   45                                       
CONECT   15    7   20   20   10                                       
CONECT   16   20   17   17   46                                       
CONECT   17   16   16    9   47                                       
CONECT   18   11   10   48                                            
CONECT   19   14   13    3                                            
CONECT   20   15   15   16                                            
CONECT   21    8    8                                                 
CONECT   22   12   24                                                 
CONECT   23    8   49                                                 
CONECT   24   22   11   25   50                                       
CONECT   25   26   24    2    2                                       
CONECT   26    1    1   25   51                                       
CONECT   27    1   28   28   52                                       
CONECT   28   27   27    2   53                                       
CONECT   29    2                                                      
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    7                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
