COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.487  -0.356   0.403  1.00  0.00           C  
HETATM    2  C   UNL     1       6.237   0.398  -0.053  1.00  0.00           C  
HETATM    3  C   UNL     1       4.998  -0.460   0.213  1.00  0.00           C  
HETATM    4  C   UNL     1       3.748   0.294  -0.244  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.593   2.676  -0.229  1.00  0.00           O  
HETATM    6  C   UNL     1       2.509  -0.564   0.022  1.00  0.00           C  
HETATM    7  C   UNL     1       0.096  -0.408  -0.278  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.136   0.334  -0.727  1.00  0.00           C  
HETATM    9  CA  UNL     1      -2.998  -0.569   0.416  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.443  -1.038   0.236  1.00  0.00           C  
HETATM   11  N   UNL     1       1.312   0.158  -0.415  1.00  0.00           N  
HETATM   12  O   UNL     1      -0.006  -1.515   0.207  1.00  0.00           O  
HETATM   13  N   UNL     1      -2.266  -0.608  -0.876  1.00  0.00           N  
HETATM   14  O   UNL     1      -4.460  -2.447  -0.005  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.954   0.931   0.803  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.964   1.663   0.106  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.545   1.366   0.340  1.00  0.00           C  
HETATM   18  H   UNL     1       7.415  -0.568   1.470  1.00  0.00           H  
HETATM   19  H   UNL     1       7.569  -1.292  -0.149  1.00  0.00           H  
HETATM   20  H   UNL     1       8.370   0.256   0.214  1.00  0.00           H  
HETATM   21  H   UNL     1       6.155   1.335   0.499  1.00  0.00           H  
HETATM   22  H   UNL     1       6.309   0.611  -1.120  1.00  0.00           H  
HETATM   23  H   UNL     1       5.080  -1.396  -0.339  1.00  0.00           H  
HETATM   24  H   UNL     1       4.925  -0.672   1.279  1.00  0.00           H  
HETATM   25  H   UNL     1       3.666   1.230   0.308  1.00  0.00           H  
HETATM   26  H   UNL     1       3.820   0.506  -1.310  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.845   3.368   0.398  1.00  0.00           H  
HETATM   28  H   UNL     1       2.591  -1.501  -0.530  1.00  0.00           H  
HETATM   29  H   UNL     1       2.437  -0.777   1.089  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.941   0.837  -1.674  1.00  0.00           H  
HETATM   31  HA  UNL     1      -2.488  -1.175   1.165  1.00  0.00           H  
HETATM   32  H1  UNL     1      -5.012  -0.817   1.140  1.00  0.00           H  
HETATM   33  H2  UNL     1      -4.891  -0.519  -0.611  1.00  0.00           H  
HETATM   34  H   UNL     1       1.394   1.043  -0.803  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.936  -1.540  -1.076  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.346  -2.814  -0.129  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.061   1.054   1.881  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.979   2.607   0.314  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.847   1.342   1.177  1.00  0.00           H  
CONECT    1    2   18   19   20                                       
CONECT    2    1    3   21   22                                       
CONECT    3    2    4   23   24                                       
CONECT    4    3    6   25   26                                       
CONECT    5   17   27                                                 
CONECT    6    4   11   28   29                                       
CONECT    7   12   12    8   11                                       
CONECT    8   13    7   17   30                                       
CONECT    9   10   13   15   31                                       
CONECT   10   14    9   32   33                                       
CONECT   11    7    6   34                                            
CONECT   12    7    7                                                 
CONECT   13    9    8   35                                            
CONECT   14   10   36                                                 
CONECT   15    9   16   17   37                                       
CONECT   16   15   38                                                 
CONECT   17    8   15    5   39                                       
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
