COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  OXT UNL     1      -5.431   2.559  -1.185  1.00  0.00           O  
HETATM    2  CA  UNL     1      -4.389   0.628  -0.054  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.673   1.201   0.039  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.529  -0.980   1.544  1.00  0.00           C  
HETATM    5  C   UNL     1       1.897  -0.892  -0.182  1.00  0.00           C  
HETATM    6  N   UNL     1       1.818   2.025   0.485  1.00  0.00           N  
HETATM    7  C   UNL     1      -3.203  -1.968   0.422  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.884  -1.192  -0.858  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.664  -0.298  -0.622  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.464  -1.161  -0.229  1.00  0.00           C  
HETATM   11 CL   UNL     1       5.746   0.260  -0.156  1.00  0.00          Cl  
HETATM   12  C   UNL     1       4.305  -0.702  -0.266  1.00  0.00           C  
HETATM   13  C   UNL     1       3.053  -0.108  -0.092  1.00  0.00           C  
HETATM   14  C   UNL     1       2.950   1.340   0.187  1.00  0.00           C  
HETATM   15  N   UNL     1       3.939   2.209   0.191  1.00  0.00           N  
HETATM   16  N   UNL     1       3.504   3.385   0.471  1.00  0.00           N  
HETATM   17  N   UNL     1       2.230   3.358   0.663  1.00  0.00           N  
HETATM   18  C   UNL     1       4.394  -2.055  -0.526  1.00  0.00           C  
HETATM   19  C   UNL     1       3.249  -2.826  -0.609  1.00  0.00           C  
HETATM   20  C   UNL     1       2.004  -2.249  -0.438  1.00  0.00           C  
HETATM   21  O   UNL     1       0.675  -0.325  -0.014  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.786  -1.926   1.057  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.002  -2.824   0.821  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.681  -0.157   1.152  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.582   1.484  -0.396  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.086  -0.315  -1.220  1.00  0.00           C  
HETATM   27  HXT UNL     1      -6.225   3.077  -1.377  1.00  0.00           H  
HETATM   28  HA  UNL     1      -3.525   1.267   0.130  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.768  -1.530   2.454  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.668  -0.336   1.723  1.00  0.00           H  
HETATM   31  H   UNL     1       0.917   1.672   0.557  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.063  -2.615   0.248  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.683  -1.892  -1.669  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.434   0.250  -1.535  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.881   0.407   0.180  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.248  -1.870  -1.029  1.00  0.00           H  
HETATM   37  H   UNL     1       5.363  -2.514  -0.660  1.00  0.00           H  
HETATM   38  H   UNL     1       3.327  -3.884  -0.812  1.00  0.00           H  
HETATM   39  H   UNL     1       1.114  -2.858  -0.505  1.00  0.00           H  
HETATM   40  H   UNL     1       0.070  -2.539   1.340  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.006  -1.218   1.856  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.233  -3.369   1.737  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.780  -3.533   0.024  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.504  -0.727   1.021  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.953  -0.946  -1.413  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.855   0.270  -2.111  1.00  0.00           H  
CONECT    1   25   27                                                 
CONECT    2   24   26   25   28                                       
CONECT    3   25   25                                                 
CONECT    4    7   24   29   30                                       
CONECT    5   20   20   13   21                                       
CONECT    6   14   17   31                                            
CONECT    7   23    4    8   32                                       
CONECT    8    7    9   26   33                                       
CONECT    9   10    8   34   35                                       
CONECT   10   22   21    9   36                                       
CONECT   11   12                                                      
CONECT   12   18   11   13   13                                       
CONECT   13   12   12    5   14                                       
CONECT   14   13    6   15   15                                       
CONECT   15   14   14   16                                            
CONECT   16   17   17   15                                            
CONECT   17    6   16   16                                            
CONECT   18   19   19   12   37                                       
CONECT   19   18   18   20   38                                       
CONECT   20   19    5    5   39                                       
CONECT   21    5   10                                                 
CONECT   22   23   10   40   41                                       
CONECT   23   22    7   42   43                                       
CONECT   24    4    2   44                                            
CONECT   25    2    3    3    1                                       
CONECT   26    8    2   45   46                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
