COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.498  -0.881   1.727  1.00  0.00           O  
HETATM    2  C   UNL     1       1.645  -0.017   0.882  1.00  0.00           C  
HETATM    3  N   UNL     1       2.884   0.377   0.530  1.00  0.00           N  
HETATM    4  CA  UNL     1       4.055  -0.235   1.163  1.00  0.00           C  
HETATM    5  C   UNL     1       4.359   0.486   2.478  1.00  0.00           C  
HETATM    6  O   UNL     1       4.739   1.836   2.204  1.00  0.00           O  
HETATM    7  C   UNL     1       5.242  -0.120   0.242  1.00  0.00           C  
HETATM    8  C   UNL     1       6.127  -1.174   0.120  1.00  0.00           C  
HETATM    9  C   UNL     1       5.443   1.039  -0.486  1.00  0.00           C  
HETATM   10  C   UNL     1       6.530   1.144  -1.332  1.00  0.00           C  
HETATM   11  C   UNL     1       7.419   0.092  -1.451  1.00  0.00           C  
HETATM   12  C   UNL     1       7.216  -1.069  -0.727  1.00  0.00           C  
HETATM   13 CL   UNL     1       8.328  -2.393  -0.880  1.00  0.00          Cl  
HETATM   14  CA  UNL     1       0.472   0.591   0.243  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.832   0.281   0.503  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.626   1.099  -0.327  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.768   1.882  -1.067  1.00  0.00           C  
HETATM   18  N   UNL     1       0.496   1.577  -0.717  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.106   1.112  -0.392  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.795   2.307  -0.620  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.050   3.604  -0.805  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.176   2.271  -0.673  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.801   1.116  -0.507  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.123  -0.002  -0.292  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.800  -0.014  -0.239  1.00  0.00           N  
HETATM   26  N   UNL     1      -5.815  -1.189  -0.123  1.00  0.00           N  
HETATM   27  CA  UNL     1      -7.278  -1.199  -0.184  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.848  -0.842   1.191  1.00  0.00           C  
HETATM   29  O   UNL     1      -7.502  -1.862   2.129  1.00  0.00           O  
HETATM   30  C   UNL     1      -7.763  -2.592  -0.591  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.297  -2.898  -2.016  1.00  0.00           C  
HETATM   32  H   UNL     1       3.001   1.066  -0.143  1.00  0.00           H  
HETATM   33  HA  UNL     1       3.852  -1.286   1.364  1.00  0.00           H  
HETATM   34  H1  UNL     1       3.470   0.480   3.109  1.00  0.00           H  
HETATM   35  H2  UNL     1       5.173  -0.023   2.992  1.00  0.00           H  
HETATM   36  H   UNL     1       4.946   2.355   2.994  1.00  0.00           H  
HETATM   37  H   UNL     1       5.968  -2.081   0.686  1.00  0.00           H  
HETATM   38  H   UNL     1       4.748   1.861  -0.394  1.00  0.00           H  
HETATM   39  H   UNL     1       6.686   2.049  -1.901  1.00  0.00           H  
HETATM   40  H   UNL     1       8.269   0.175  -2.112  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.189  -0.453   1.211  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.059   2.619  -1.801  1.00  0.00           H  
HETATM   43  H   UNL     1       1.296   1.983  -1.087  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.828   3.748  -1.863  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.665   4.430  -0.448  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.119   3.572  -0.240  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.740   3.176  -0.848  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.330  -2.015   0.035  1.00  0.00           H  
HETATM   49  HA  UNL     1      -7.616  -0.468  -0.918  1.00  0.00           H  
HETATM   50  H1  UNL     1      -7.433   0.111   1.520  1.00  0.00           H  
HETATM   51  H2  UNL     1      -8.933  -0.762   1.125  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.831  -1.702   3.024  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.351  -3.334   0.094  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.851  -2.624  -0.550  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.708  -2.156  -2.700  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.208  -2.865  -2.056  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.642  -3.890  -2.305  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3   14    1    1                                       
CONECT    3    4    2   32                                            
CONECT    4    5    3    7   33                                       
CONECT    5    6    4   34   35                                       
CONECT    6    5   36                                                 
CONECT    7    4    8    8    9                                       
CONECT    8    7    7   12   37                                       
CONECT    9    7   10   10   38                                       
CONECT   10    9    9   11   39                                       
CONECT   11   12   12   10   40                                       
CONECT   12    8   13   11   11                                       
CONECT   13   12                                                      
CONECT   14   18    2   15   15                                       
CONECT   15   14   14   16   41                                       
CONECT   16   17   17   19   15                                       
CONECT   17   18   16   16   42                                       
CONECT   18   17   14   43                                            
CONECT   19   25   16   20   20                                       
CONECT   20   19   19   22   21                                       
CONECT   21   20   44   45   46                                       
CONECT   22   23   23   20   47                                       
CONECT   23   24   22   22                                            
CONECT   24   26   25   25   23                                       
CONECT   25   24   24   19                                            
CONECT   26   27   24   48                                            
CONECT   27   28   30   26   49                                       
CONECT   28   29   27   50   51                                       
CONECT   29   28   52                                                 
CONECT   30   27   31   53   54                                       
CONECT   31   30   55   56   57                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   11                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
