COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -8.554  -2.327   0.087  1.00  0.00           O  
HETATM    2  C   UNL     1      -7.415  -1.585   0.079  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.179  -2.211  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.023  -1.457  -0.009  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.489  -0.201   0.146  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.332   0.554   0.138  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.096  -0.073   0.063  1.00  0.00           C  
HETATM    8  N   UNL     1      -3.920   0.694   0.055  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.651   0.227  -0.014  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.832   2.092   0.110  1.00  0.00           N  
HETATM   11  N   UNL     1      -2.587   2.420   0.081  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.830   1.315   0.006  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.349   1.283  -0.046  1.00  0.00           C  
HETATM   14  N   UNL     1       0.268   0.119  -0.123  1.00  0.00           N  
HETATM   15  C   UNL     1       0.365   2.491  -0.017  1.00  0.00           C  
HETATM   16  C   UNL     1       1.727   2.476  -0.065  1.00  0.00           C  
HETATM   17  C   UNL     1       2.378   1.228  -0.142  1.00  0.00           C  
HETATM   18  C   UNL     1       3.777   1.141  -0.195  1.00  0.00           C  
HETATM   19  C   UNL     1       1.601   0.043  -0.178  1.00  0.00           C  
HETATM   20  C   UNL     1       2.251  -1.202  -0.255  1.00  0.00           C  
HETATM   21  C   UNL     1       3.609  -1.254  -0.295  1.00  0.00           C  
HETATM   22  C   UNL     1       4.376  -0.086  -0.270  1.00  0.00           C  
HETATM   23  O   UNL     1       5.731  -0.170  -0.311  1.00  0.00           O  
HETATM   24  C   UNL     1       6.298  -1.480  -0.378  1.00  0.00           C  
HETATM   25  C   UNL     1       7.824  -1.375  -0.417  1.00  0.00           C  
HETATM   26  O   UNL     1       8.294  -0.822   0.815  1.00  0.00           O  
HETATM   27  C   UNL     1       9.714  -0.681   0.883  1.00  0.00           C  
HETATM   28  H   UNL     1      -8.848  -2.586   0.970  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.122  -3.288  -0.057  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.061  -1.944  -0.071  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.451   0.286   0.204  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.390   1.631   0.189  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.347  -0.808  -0.072  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.164   3.431   0.042  1.00  0.00           H  
HETATM   35  H   UNL     1       2.292   3.395  -0.044  1.00  0.00           H  
HETATM   36  H   UNL     1       4.378   2.038  -0.177  1.00  0.00           H  
HETATM   37  H   UNL     1       1.672  -2.113  -0.283  1.00  0.00           H  
HETATM   38  H   UNL     1       4.103  -2.213  -0.354  1.00  0.00           H  
HETATM   39  H   UNL     1       5.995  -2.053   0.499  1.00  0.00           H  
HETATM   40  H   UNL     1       5.946  -1.983  -1.279  1.00  0.00           H  
HETATM   41  H   UNL     1       8.253  -2.367  -0.557  1.00  0.00           H  
HETATM   42  H   UNL     1       8.123  -0.729  -1.242  1.00  0.00           H  
HETATM   43  H   UNL     1      10.183  -1.658   0.770  1.00  0.00           H  
HETATM   44  H   UNL     1      10.053  -0.021   0.084  1.00  0.00           H  
HETATM   45  H   UNL     1       9.991  -0.255   1.848  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    5    5    3    1                                       
CONECT    3    4    4    2   29                                       
CONECT    4    7    3    3   30                                       
CONECT    5    6    2    2   31                                       
CONECT    6    7    7    5   32                                       
CONECT    7    8    6    6    4                                       
CONECT    8   10    9    7                                            
CONECT    9   12   12    8   33                                       
CONECT   10   11   11    8                                            
CONECT   11   12   10   10                                            
CONECT   12   13   11    9    9                                       
CONECT   13   14   14   15   12                                       
CONECT   14   19   13   13                                            
CONECT   15   16   16   13   34                                       
CONECT   16   17   15   15   35                                       
CONECT   17   18   18   19   16                                       
CONECT   18   22   17   17   36                                       
CONECT   19   20   20   17   14                                       
CONECT   20   21   19   19   37                                       
CONECT   21   22   22   20   38                                       
CONECT   22   23   21   21   18                                       
CONECT   23   24   22                                                 
CONECT   24   25   23   39   40                                       
CONECT   25   26   24   41   42                                       
CONECT   26   27   25                                                 
CONECT   27   26   43   44   45                                       
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    9                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   18                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
CONECT   41   25                                                      
CONECT   42   25                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
