COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.474   1.051  -0.770  1.00  0.00           C  
HETATM    2  C   UNL     1       1.217  -0.312   0.561  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.903  -0.695  -0.698  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.813  -2.222  -0.671  1.00  0.00           C  
HETATM    5  C   UNL     1       0.008  -2.705  -1.868  1.00  0.00           C  
HETATM    6  C   UNL     1       0.204  -4.220  -1.774  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.733  -2.367  -3.164  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.812  -0.226   0.410  1.00  0.00           C  
HETATM    9  CA  UNL     1      -3.981  -0.172   1.518  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.429  -0.169   1.023  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.584   0.866  -0.093  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.351   2.292   0.456  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.381   3.113  -0.352  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.011   0.890  -0.597  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.855  -1.100   2.698  1.00  0.00           C  
HETATM   16  C   UNL     1       1.131   0.752  -1.463  1.00  0.00           C  
HETATM   17  N   UNL     1       0.432  -0.123  -0.509  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.098  -0.627   0.442  1.00  0.00           N  
HETATM   19  N   UNL     1      -7.433   2.160  -0.727  1.00  0.00           N  
HETATM   20  O   UNL     1       2.392   0.322   0.488  1.00  0.00           O  
HETATM   21  O   UNL     1      -7.676  -0.092  -0.847  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.105  -2.045   2.646  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.385   0.514   1.271  1.00  0.00           O  
HETATM   24  O   UNL     1       0.890  -0.995   1.511  1.00  0.00           O  
HETATM   25  H   UNL     1       2.579   2.121  -0.586  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.304  -0.371  -1.658  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.330  -2.541   0.253  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.815  -2.646  -0.722  1.00  0.00           H  
HETATM   29  H   UNL     1       0.980  -2.212  -1.865  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.768  -4.713  -1.776  1.00  0.00           H  
HETATM   31  H   UNL     1       0.788  -4.564  -2.627  1.00  0.00           H  
HETATM   32  H   UNL     1       0.731  -4.461  -0.851  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.872  -1.288  -3.231  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.148  -2.711  -4.017  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.705  -2.860  -3.166  1.00  0.00           H  
HETATM   36  HA  UNL     1      -3.697   0.837   1.818  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.683  -1.158   0.641  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.094   0.084   1.849  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.893   0.653  -0.908  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.565   2.340   1.523  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.335   2.629   0.248  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.797   3.909   0.265  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.915   3.532  -1.243  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.435  -0.920   3.591  1.00  0.00           H  
HETATM   45  H   UNL     1       0.569   1.672  -1.622  1.00  0.00           H  
HETATM   46  H   UNL     1       1.295   0.236  -2.409  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.439  -1.219  -0.248  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.319   2.414  -1.031  1.00  0.00           H  
HETATM   49  C   UNL     1       3.641   0.538  -1.616  1.00  0.00           C  
HETATM   50  C   UNL     1       5.534   2.149  -1.330  1.00  0.00           C  
HETATM   51  C   UNL     1       6.728   2.529  -0.746  1.00  0.00           C  
HETATM   52  C   UNL     1       7.336   1.705   0.183  1.00  0.00           C  
HETATM   53  C   UNL     1       6.748   0.502   0.529  1.00  0.00           C  
HETATM   54  C   UNL     1       5.552   0.123  -0.055  1.00  0.00           C  
HETATM   55  C   UNL     1       4.943   0.950  -0.980  1.00  0.00           C  
HETATM   56 CL   UNL     1       7.510  -0.533   1.696  1.00  0.00          Cl  
HETATM   57  H   UNL     1       3.594  -0.550  -1.677  1.00  0.00           H  
HETATM   58  H   UNL     1       3.576   0.961  -2.619  1.00  0.00           H  
HETATM   59  H   UNL     1       5.060   2.793  -2.056  1.00  0.00           H  
HETATM   60  H   UNL     1       7.187   3.468  -1.016  1.00  0.00           H  
HETATM   61  H   UNL     1       8.269   2.001   0.638  1.00  0.00           H  
HETATM   62  H   UNL     1       5.093  -0.817   0.215  1.00  0.00           H  
CONECT    1   20   16   25   49                                       
CONECT    2   24   24   20   17                                       
CONECT    3    8   17    4   26                                       
CONECT    4    3    5   27   28                                       
CONECT    5    4    6    7   29                                       
CONECT    6    5   30   31   32                                       
CONECT    7    5   33   34   35                                       
CONECT    8   18   23   23    3                                       
CONECT    9   10   15   18   36                                       
CONECT   10   11    9   37   38                                       
CONECT   11   14   10   12   39                                       
CONECT   12   13   11   40   41                                       
CONECT   13   19   12   42   43                                       
CONECT   14   21   21   19   11                                       
CONECT   15    9   22   22   44                                       
CONECT   16   17    1   45   46                                       
CONECT   17    2    3   16                                            
CONECT   18    9    8   47                                            
CONECT   19   14   13   48                                            
CONECT   20    2    1                                                 
CONECT   21   14   14                                                 
CONECT   22   15   15                                                 
CONECT   23    8    8                                                 
CONECT   24    2    2                                                 
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49    1   55   57   58                                       
CONECT   50   51   55   55   59                                       
CONECT   51   50   52   52   60                                       
CONECT   52   51   51   53   61                                       
CONECT   53   52   54   54   56                                       
CONECT   54   53   53   55   62                                       
CONECT   55   54   50   50   49                                       
CONECT   56   53                                                      
CONECT   57   49                                                      
CONECT   58   49                                                      
CONECT   59   50                                                      
CONECT   60   51                                                      
CONECT   61   52                                                      
CONECT   62   54                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
