COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.882  -1.584  -0.055  1.00  0.00           C  
HETATM    2  C   UNL     1       1.305   0.630   0.022  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.997   2.028   0.088  1.00  0.00           C  
HETATM    4  N   UNL     1       0.164   0.060   0.329  1.00  0.00           N  
HETATM    5  C   UNL     1       0.188   2.718  -0.252  1.00  0.00           C  
HETATM    6  C   UNL     1       1.352   2.010  -0.285  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.941   0.712   0.365  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.175   0.005   0.717  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.828  -0.544  -0.553  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.097  -1.272  -0.190  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.444  -1.344   0.965  1.00  0.00           O  
HETATM   12  O   UNL     1      -4.843  -1.840  -1.151  1.00  0.00           O  
HETATM   13  O   UNL     1      -2.063   2.621   0.131  1.00  0.00           O  
HETATM   14  C   UNL     1       2.552  -0.174   0.002  1.00  0.00           C  
HETATM   15  C   UNL     1       2.523  -1.537   0.309  1.00  0.00           C  
HETATM   16  C   UNL     1       3.771   0.418  -0.322  1.00  0.00           C  
HETATM   17  N   UNL     1       4.878  -0.295  -0.340  1.00  0.00           N  
HETATM   18  C   UNL     1       3.713  -2.243   0.276  1.00  0.00           C  
HETATM   19  H   UNL     1       5.812  -2.132  -0.086  1.00  0.00           H  
HETATM   20  H   UNL     1       0.171   3.774  -0.479  1.00  0.00           H  
HETATM   21  H   UNL     1       2.286   2.490  -0.539  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.941  -0.820   1.391  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.861   0.694   1.210  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.062   0.280  -1.227  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.142  -1.234  -1.046  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.648  -2.295  -0.870  1.00  0.00           H  
HETATM   27  H   UNL     1       1.595  -2.027   0.565  1.00  0.00           H  
HETATM   28  H   UNL     1       3.809   1.470  -0.562  1.00  0.00           H  
HETATM   29  H   UNL     1       3.728  -3.298   0.507  1.00  0.00           H  
CONECT    1   18   18   17   19                                       
CONECT    2   14    4    4    6                                       
CONECT    3    7    5   13   13                                       
CONECT    4    2    2    7                                            
CONECT    5    6    6    3   20                                       
CONECT    6    2    5    5   21                                       
CONECT    7    4    8    3                                            
CONECT    8    9    7   22   23                                       
CONECT    9   10    8   24   25                                       
CONECT   10   11   11    9   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   26                                                 
CONECT   13    3    3                                                 
CONECT   14   15   15   16    2                                       
CONECT   15   18   14   14   27                                       
CONECT   16   17   17   14   28                                       
CONECT   17    1   16   16                                            
CONECT   18    1    1   15   29                                       
CONECT   19    1                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    8                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   12                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   18                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
