COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.814  -3.027  -1.095  1.00  0.00           C  
HETATM    2  C   UNL     1       6.666  -2.270  -0.426  1.00  0.00           C  
HETATM    3  C   UNL     1       6.433  -2.833   0.978  1.00  0.00           C  
HETATM    4  N   UNL     1       7.008  -0.849  -0.330  1.00  0.00           N  
HETATM    5  C   UNL     1       5.999   0.107  -0.259  1.00  0.00           C  
HETATM    6  C   UNL     1       4.671  -0.295  -0.279  1.00  0.00           C  
HETATM    7  C   UNL     1       3.670   0.674  -0.206  1.00  0.00           C  
HETATM    8  C   UNL     1       2.237   0.292  -0.224  1.00  0.00           C  
HETATM    9  CA  UNL     1       0.074   0.132   0.303  1.00  0.00           C  
HETATM   10  C   UNL     1       1.247   0.720   0.683  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.225   0.296   0.966  1.00  0.00           C  
HETATM   12  CA  UNL     1      -3.608  -0.179   1.150  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.713  -0.442   0.161  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.604  -1.712  -1.664  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.741  -0.927  -1.656  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.863   0.105  -0.743  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.847   0.347   0.166  1.00  0.00           C  
HETATM   18  C   UNL     1       4.054   2.018  -0.117  1.00  0.00           C  
HETATM   19  C   UNL     1       5.397   2.334  -0.103  1.00  0.00           C  
HETATM   20  C   UNL     1       1.626  -0.543  -1.132  1.00  0.00           C  
HETATM   21  N   UNL     1       0.320  -0.639  -0.810  1.00  0.00           N  
HETATM   22  O   UNL     1      -1.322   1.010   1.946  1.00  0.00           O  
HETATM   23  N   UNL     1      -2.311  -0.344   0.489  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.717  -1.169   2.312  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.719  -2.504   1.802  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.590  -1.470  -0.756  1.00  0.00           C  
HETATM   27 CL   UNL     1      -8.290   1.092  -0.733  1.00  0.00          Cl  
HETATM   28 CL   UNL     1       2.856   3.270  -0.024  1.00  0.00          Cl  
HETATM   29  N   UNL     1       6.317   1.390  -0.168  1.00  0.00           N  
HETATM   30  H   UNL     1       8.721  -2.911  -0.502  1.00  0.00           H  
HETATM   31  H   UNL     1       7.559  -4.085  -1.166  1.00  0.00           H  
HETATM   32  H   UNL     1       7.980  -2.626  -2.095  1.00  0.00           H  
HETATM   33  H   UNL     1       5.759  -2.386  -1.019  1.00  0.00           H  
HETATM   34  H   UNL     1       5.614  -2.293   1.455  1.00  0.00           H  
HETATM   35  H   UNL     1       6.178  -3.891   0.907  1.00  0.00           H  
HETATM   36  H   UNL     1       7.339  -2.717   1.571  1.00  0.00           H  
HETATM   37  H   UNL     1       7.938  -0.574  -0.317  1.00  0.00           H  
HETATM   38  H   UNL     1       4.416  -1.342  -0.350  1.00  0.00           H  
HETATM   39  H   UNL     1       1.389   1.387   1.520  1.00  0.00           H  
HETATM   40  HA  UNL     1      -3.695   0.839   1.530  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.509  -2.518  -2.377  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.535  -1.118  -2.363  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.942   1.153   0.879  1.00  0.00           H  
HETATM   44  H   UNL     1       5.699   3.368  -0.034  1.00  0.00           H  
HETATM   45  H   UNL     1       2.110  -1.038  -1.960  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.340  -1.166  -1.288  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.234  -0.913  -0.293  1.00  0.00           H  
HETATM   48  H1  UNL     1      -2.867  -1.037   2.982  1.00  0.00           H  
HETATM   49  H2  UNL     1      -4.642  -0.987   2.858  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.786  -3.185   2.484  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.702  -2.085  -0.762  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    3    1    4   33                                       
CONECT    3    2   34   35   36                                       
CONECT    4    2    5   37                                            
CONECT    5    4    6    6   29                                       
CONECT    6    5    5    7   38                                       
CONECT    7    6    8   18   18                                       
CONECT    8   20   20    7   10                                       
CONECT    9   21   10   10   11                                       
CONECT   10    8    9    9   39                                       
CONECT   11    9   23   22   22                                       
CONECT   12   24   23   13   40                                       
CONECT   13   12   17   17   26                                       
CONECT   14   26   26   15   41                                       
CONECT   15   16   16   14   42                                       
CONECT   16   17   15   15   27                                       
CONECT   17   13   13   16   43                                       
CONECT   18    7    7   19   28                                       
CONECT   19   29   29   18   44                                       
CONECT   20   21    8    8   45                                       
CONECT   21   20    9   46                                            
CONECT   22   11   11                                                 
CONECT   23   11   12   47                                            
CONECT   24   25   12   48   49                                       
CONECT   25   24   50                                                 
CONECT   26   13   14   14   51                                       
CONECT   27   16                                                      
CONECT   28   18                                                      
CONECT   29    5   19   19                                            
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
