COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.140   1.189   0.475  1.00  0.00           C  
HETATM    2  C   UNL     1       2.734   0.663   0.601  1.00  0.00           C  
HETATM    3  C   UNL     1       2.764  -0.866   0.655  1.00  0.00           C  
HETATM    4  C   UNL     1       1.351  -1.397   0.909  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.818  -1.440  -0.001  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.868  -0.515   0.046  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.964   0.946  -0.094  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.322   1.267   0.059  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.722   2.597  -0.026  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.789   3.584  -0.259  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.448   3.266  -0.410  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.032   1.954  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.171  -0.983   0.275  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.340  -3.128   0.385  1.00  0.00           C  
HETATM   15  C   UNL     1       1.006  -1.565  -1.480  1.00  0.00           C  
HETATM   16  C   UNL     1       2.423  -1.033  -1.710  1.00  0.00           C  
HETATM   17  N   UNL     1       0.483  -1.023  -0.218  1.00  0.00           N  
HETATM   18  N   UNL     1      -4.024   0.094   0.279  1.00  0.00           N  
HETATM   19  N   UNL     1      -3.356  -2.293   0.437  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.100  -2.729   0.174  1.00  0.00           N  
HETATM   21  O   UNL     1       4.358   2.512   0.409  1.00  0.00           O  
HETATM   22  O   UNL     1       3.244  -1.378  -0.591  1.00  0.00           O  
HETATM   23  O   UNL     1       5.071   0.421   0.437  1.00  0.00           O  
HETATM   24  H   UNL     1       2.282   1.050   1.515  1.00  0.00           H  
HETATM   25  H   UNL     1       2.146   0.984  -0.259  1.00  0.00           H  
HETATM   26  H   UNL     1       3.424  -1.189   1.461  1.00  0.00           H  
HETATM   27  H   UNL     1       1.381  -2.483   1.000  1.00  0.00           H  
HETATM   28  H   UNL     1       0.959  -0.964   1.829  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.764   2.855   0.089  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.105   4.615  -0.324  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.726   4.049  -0.591  1.00  0.00           H  
HETATM   32  H   UNL     1       0.013   1.709  -0.447  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.529  -4.183   0.522  1.00  0.00           H  
HETATM   34  H   UNL     1       0.363  -1.255  -2.304  1.00  0.00           H  
HETATM   35  H   UNL     1       1.030  -2.654  -1.427  1.00  0.00           H  
HETATM   36  H   UNL     1       2.836  -1.477  -2.615  1.00  0.00           H  
HETATM   37  H   UNL     1       2.391   0.052  -1.818  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.983   0.040   0.416  1.00  0.00           H  
HETATM   39  H   UNL     1       5.277   2.802   0.329  1.00  0.00           H  
CONECT    1   23   23   21    2                                       
CONECT    2    1    3   24   25                                       
CONECT    3   22    2    4   26                                       
CONECT    4    3   17   27   28                                       
CONECT    5   17   20   20    6                                       
CONECT    6    5    7   13   13                                       
CONECT    7   12    6    8    8                                       
CONECT    8    7    7    9   18                                       
CONECT    9   10   10    8   29                                       
CONECT   10   11    9    9   30                                       
CONECT   11   12   12   10   31                                       
CONECT   12   11   11    7   32                                       
CONECT   13    6    6   18   19                                       
CONECT   14   20   19   19   33                                       
CONECT   15   16   17   34   35                                       
CONECT   16   22   15   36   37                                       
CONECT   17   15    4    5                                            
CONECT   18    8   13   38                                            
CONECT   19   14   14   13                                            
CONECT   20    5    5   14                                            
CONECT   21    1   39                                                 
CONECT   22   16    3                                                 
CONECT   23    1    1                                                 
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   18                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
