COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.836   2.852   0.143  1.00  0.00           O  
HETATM    2  O   UNL     1      -0.160  -2.089   1.643  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.780   1.496   0.233  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.940   0.741   0.081  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.608   3.564   0.308  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.226  -1.196   0.819  1.00  0.00           C  
HETATM    7  C   UNL     1       1.721   1.423  -0.165  1.00  0.00           C  
HETATM    8  C   UNL     1       3.032   0.873   0.335  1.00  0.00           C  
HETATM    9  C   UNL     1       3.243  -0.471   0.549  1.00  0.00           C  
HETATM   10  C   UNL     1       2.176  -1.507   0.287  1.00  0.00           C  
HETATM   11  C   UNL     1       2.478  -2.196  -1.050  1.00  0.00           C  
HETATM   12  O   UNL     1       1.443   0.539  -3.071  1.00  0.00           O  
HETATM   13  C   UNL     1       1.564  -0.142  -2.075  1.00  0.00           C  
HETATM   14  C   UNL     1       0.887   0.311  -0.808  1.00  0.00           C  
HETATM   15  N   UNL     1       2.290  -1.260  -2.151  1.00  0.00           N  
HETATM   16  C   UNL     1       4.472  -0.912   1.019  1.00  0.00           C  
HETATM   17  C   UNL     1       5.489  -0.012   1.270  1.00  0.00           C  
HETATM   18  C   UNL     1       5.280   1.337   1.050  1.00  0.00           C  
HETATM   19  C   UNL     1       4.057   1.776   0.585  1.00  0.00           C  
HETATM   20  N   UNL     1       0.877  -0.821   0.142  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.515  -0.524   0.561  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.681  -1.280   0.414  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.571   0.869   0.469  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.126   1.359  -0.157  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.886  -0.648   0.172  1.00  0.00           C  
HETATM   26  O   UNL     1      -5.021  -1.383   0.023  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.893  -2.802   0.128  1.00  0.00           C  
HETATM   28  H   UNL     1      -1.196   3.353   1.295  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.899   3.248  -0.457  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.793   4.634   0.213  1.00  0.00           H  
HETATM   31  H   UNL     1       1.168   1.852   0.670  1.00  0.00           H  
HETATM   32  H   UNL     1       1.918   2.200  -0.904  1.00  0.00           H  
HETATM   33  H   UNL     1       2.145  -2.237   1.096  1.00  0.00           H  
HETATM   34  H   UNL     1       3.508  -2.551  -1.049  1.00  0.00           H  
HETATM   35  H   UNL     1       1.805  -3.045  -1.178  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.124   0.660  -1.017  1.00  0.00           H  
HETATM   37  H   UNL     1       2.722  -1.462  -2.996  1.00  0.00           H  
HETATM   38  H   UNL     1       4.635  -1.965   1.190  1.00  0.00           H  
HETATM   39  H   UNL     1       6.443  -0.361   1.636  1.00  0.00           H  
HETATM   40  H   UNL     1       6.072   2.045   1.243  1.00  0.00           H  
HETATM   41  H   UNL     1       3.896   2.830   0.415  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.640  -2.356   0.488  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.672   1.455   0.582  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.322   1.487  -1.095  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.869  -3.266  -0.010  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.208  -3.163  -0.639  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.504  -3.060   1.113  1.00  0.00           H  
CONECT    1    5    3                                                 
CONECT    2    6    6                                                 
CONECT    3   23    1    4    4                                       
CONECT    4    3    3   25   24                                       
CONECT    5    1   28   29   30                                       
CONECT    6   20    2    2   21                                       
CONECT    7    8   14   31   32                                       
CONECT    8   19   19    9    7                                       
CONECT    9   16   16    8   10                                       
CONECT   10    9   11   20   33                                       
CONECT   11   10   15   34   35                                       
CONECT   12   13   13                                                 
CONECT   13   15   14   12   12                                       
CONECT   14    7   20   13   36                                       
CONECT   15   11   13   37                                            
CONECT   16   17    9    9   38                                       
CONECT   17   18   18   16   39                                       
CONECT   18   17   17   19   40                                       
CONECT   19   18    8    8   41                                       
CONECT   20   10    6   14                                            
CONECT   21    6   23   23   22                                       
CONECT   22   21   25   25   42                                       
CONECT   23   21   21    3   43                                       
CONECT   24    4   44                                                 
CONECT   25   22   22    4   26                                       
CONECT   26   25   27                                                 
CONECT   27   26   45   46   47                                       
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
