COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O5* UNL     1      -3.476  -2.764  -0.625  1.00  0.00           O  
HETATM    2  C5* UNL     1      -3.514  -1.720   0.350  1.00  0.00           C  
HETATM    3  C4* UNL     1      -2.961  -0.432  -0.261  1.00  0.00           C  
HETATM    4  C3* UNL     1      -3.107   0.741   0.734  1.00  0.00           C  
HETATM    5  O3* UNL     1      -4.266   1.519   0.428  1.00  0.00           O  
HETATM    6  O4* UNL     1      -1.538  -0.550  -0.488  1.00  0.00           O  
HETATM    7  C1* UNL     1      -1.054   0.808  -0.576  1.00  0.00           C  
HETATM    8  C2* UNL     1      -1.824   1.576   0.522  1.00  0.00           C  
HETATM    9  N   UNL     1       0.387   0.854  -0.314  1.00  0.00           N  
HETATM   10  C   UNL     1       1.190  -0.235  -0.082  1.00  0.00           C  
HETATM   11  N   UNL     1       0.911  -1.511   0.049  1.00  0.00           N  
HETATM   12  C   UNL     1       2.524   0.260   0.001  1.00  0.00           C  
HETATM   13  N   UNL     1       2.432   1.652  -0.036  1.00  0.00           N  
HETATM   14  C   UNL     1       1.139   1.972  -0.263  1.00  0.00           C  
HETATM   15  O   UNL     1       0.715   3.104  -0.402  1.00  0.00           O  
HETATM   16  C   UNL     1       3.591  -0.583   0.112  1.00  0.00           C  
HETATM   17  N   UNL     1       4.874  -0.125   0.312  1.00  0.00           N  
HETATM   18  N   UNL     1       3.293  -1.937   0.004  1.00  0.00           N  
HETATM   19  C   UNL     1       1.985  -2.432   0.444  1.00  0.00           C  
HETATM   20  H5* UNL     1      -3.833  -3.557  -0.200  1.00  0.00           H  
HETATM   21 H5*1 UNL     1      -2.908  -2.004   1.210  1.00  0.00           H  
HETATM   22 H5*2 UNL     1      -4.544  -1.558   0.669  1.00  0.00           H  
HETATM   23  H4* UNL     1      -3.475  -0.204  -1.195  1.00  0.00           H  
HETATM   24  H3* UNL     1      -3.157   0.370   1.757  1.00  0.00           H  
HETATM   25  H3* UNL     1      -4.271   2.267   1.040  1.00  0.00           H  
HETATM   26  H1* UNL     1      -1.274   1.227  -1.557  1.00  0.00           H  
HETATM   27 H2*1 UNL     1      -1.239   1.617   1.441  1.00  0.00           H  
HETATM   28 H2*2 UNL     1      -2.074   2.581   0.181  1.00  0.00           H  
HETATM   29  H   UNL     1       3.164   2.278   0.082  1.00  0.00           H  
HETATM   30  H   UNL     1       5.044   0.827   0.379  1.00  0.00           H  
HETATM   31  H   UNL     1       5.607  -0.756   0.391  1.00  0.00           H  
HETATM   32  H   UNL     1       3.950  -2.553  -0.357  1.00  0.00           H  
HETATM   33  H   UNL     1       1.985  -2.535   1.529  1.00  0.00           H  
HETATM   34  H   UNL     1       1.804  -3.407  -0.007  1.00  0.00           H  
CONECT    1    2   20                                                 
CONECT    2    1    3   21   22                                       
CONECT    3    2    4    6   23                                       
CONECT    4    3    5    8   24                                       
CONECT    5    4   25                                                 
CONECT    6    3    7                                                 
CONECT    7    6    8    9   26                                       
CONECT    8    4    7   27   28                                       
CONECT    9    7   10   14                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10   19                                            
CONECT   12   10   13   16   16                                       
CONECT   13   12   14   29                                            
CONECT   14    9   13   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   12   12   17   18                                       
CONECT   17   16   30   31                                            
CONECT   18   16   19   32                                            
CONECT   19   11   18   33   34                                       
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    5                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28    8                                                      
CONECT   29   13                                                      
CONECT   30   17                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   19                                                      
CONECT   34   19                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
