COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.854   1.612   1.942  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.285  -0.377   0.140  1.00  0.00           C  
HETATM    3  C   UNL     1       0.317  -1.439   0.042  1.00  0.00           C  
HETATM    4  C   UNL     1       2.126  -2.802   1.108  1.00  0.00           C  
HETATM    5  C   UNL     1       4.076  -1.479  -0.341  1.00  0.00           C  
HETATM    6  C   UNL     1       2.739  -1.148  -0.511  1.00  0.00           C  
HETATM    7  C   UNL     1       4.585   1.099   0.257  1.00  0.00           C  
HETATM    8  C   UNL     1       5.667   3.168  -0.275  1.00  0.00           C  
HETATM    9  C   UNL     1       6.120   1.217  -1.587  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.159  -1.002  -1.582  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.442  -1.009  -2.084  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.396  -0.140  -1.576  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.074   0.740  -0.566  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.784   0.762  -0.045  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.819  -0.118  -0.560  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.576   0.143   0.183  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.866   1.167   1.103  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.195   1.523   0.949  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.646   1.089   1.874  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.336   0.127   1.016  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.037  -0.380   0.990  1.00  0.00           N  
HETATM   22  C   UNL     1       1.768  -1.806   0.218  1.00  0.00           C  
HETATM   23  C   UNL     1       3.457  -3.137   1.275  1.00  0.00           C  
HETATM   24  C   UNL     1       4.432  -2.478   0.553  1.00  0.00           C  
HETATM   25  O   UNL     1       5.033  -0.833  -1.057  1.00  0.00           O  
HETATM   26  C   UNL     1       5.244   0.484  -0.798  1.00  0.00           C  
HETATM   27  C   UNL     1       4.798   2.439   0.516  1.00  0.00           C  
HETATM   28  C   UNL     1       6.325   2.558  -1.327  1.00  0.00           C  
HETATM   29  H   UNL     1      -3.058   2.397   2.655  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.031  -1.164  -0.555  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.305  -2.315   0.228  1.00  0.00           H  
HETATM   32  H   UNL     1       0.152  -1.086  -0.975  1.00  0.00           H  
HETATM   33  H   UNL     1       1.365  -3.315   1.677  1.00  0.00           H  
HETATM   34  H   UNL     1       2.459  -0.370  -1.206  1.00  0.00           H  
HETATM   35  H   UNL     1       3.903   0.531   0.873  1.00  0.00           H  
HETATM   36  H   UNL     1       5.831   4.216  -0.072  1.00  0.00           H  
HETATM   37  H   UNL     1       6.634   0.740  -2.409  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.418  -1.680  -1.980  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.706  -1.694  -2.877  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.399  -0.153  -1.976  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.825   1.412  -0.177  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.649   2.209   1.464  1.00  0.00           H  
HETATM   43  H   UNL     1       0.632  -0.031   1.600  1.00  0.00           H  
HETATM   44  H   UNL     1       3.734  -3.915   1.972  1.00  0.00           H  
HETATM   45  H   UNL     1       5.472  -2.737   0.687  1.00  0.00           H  
HETATM   46  H   UNL     1       4.284   2.918   1.336  1.00  0.00           H  
HETATM   47  H   UNL     1       7.002   3.129  -1.944  1.00  0.00           H  
CONECT    1   19   19   17   29                                       
CONECT    2   20   20   16   30                                       
CONECT    3   22   21   31   32                                       
CONECT    4   23   23   22   33                                       
CONECT    5   25   24   24    6                                       
CONECT    6    5   22   22   34                                       
CONECT    7   27   26   26   35                                       
CONECT    8   27   27   28   36                                       
CONECT    9   28   28   26   37                                       
CONECT   10   15   15   11   38                                       
CONECT   11   10   12   12   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   14   14   12   41                                       
CONECT   14   15   18   13   13                                       
CONECT   15   16   10   10   14                                       
CONECT   16    2   17   17   15                                       
CONECT   17   16   16    1   18                                       
CONECT   18   17   14   42                                            
CONECT   19   20    1    1                                            
CONECT   20   21    2    2   19                                       
CONECT   21    3   20   43                                            
CONECT   22    6    6    4    3                                       
CONECT   23   24    4    4   44                                       
CONECT   24    5    5   23   45                                       
CONECT   25   26    5                                                 
CONECT   26    7    7    9   25                                       
CONECT   27    8    8    7   46                                       
CONECT   28    8    9    9   47                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   18                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
