COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.993  -1.012   1.319  1.00  0.00           C  
HETATM    2  C   UNL     1       4.647  -2.285   0.777  1.00  0.00           C  
HETATM    3  C   UNL     1       5.495  -1.936  -0.448  1.00  0.00           C  
HETATM    4  C   UNL     1       4.607  -1.266  -1.500  1.00  0.00           C  
HETATM    5  C   UNL     1       3.954  -0.022  -0.892  1.00  0.00           C  
HETATM    6  N   UNL     1       3.154  -0.409   0.276  1.00  0.00           N  
HETATM    7  C   UNL     1       2.402   0.738   0.803  1.00  0.00           C  
HETATM    8  C   UNL     1       1.362   1.183  -0.227  1.00  0.00           C  
HETATM    9  O   UNL     1       0.352   0.166  -0.401  1.00  0.00           O  
HETATM   10  C   UNL     1       0.561   2.402   0.297  1.00  0.00           C  
HETATM   11  O   UNL     1       1.237   3.624  -0.005  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.760   2.290  -0.502  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.808   0.815  -0.948  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.024   0.179  -0.435  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.974  -0.273  -1.310  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.094  -0.860  -0.837  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.150  -1.365  -1.786  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.262  -0.996   0.562  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.264  -1.522   1.012  1.00  0.00           O  
HETATM   20  N   UNL     1      -3.303  -0.537   1.391  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.194   0.040   0.893  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.336   0.445   1.653  1.00  0.00           O  
HETATM   23  H   UNL     1       3.377  -1.259   2.184  1.00  0.00           H  
HETATM   24  H   UNL     1       4.767  -0.304   1.616  1.00  0.00           H  
HETATM   25  H   UNL     1       5.282  -2.724   1.547  1.00  0.00           H  
HETATM   26  H   UNL     1       3.873  -2.998   0.493  1.00  0.00           H  
HETATM   27  H   UNL     1       6.293  -1.252  -0.157  1.00  0.00           H  
HETATM   28  H   UNL     1       5.928  -2.846  -0.863  1.00  0.00           H  
HETATM   29  H   UNL     1       5.213  -0.976  -2.358  1.00  0.00           H  
HETATM   30  H   UNL     1       3.832  -1.963  -1.820  1.00  0.00           H  
HETATM   31  H   UNL     1       4.729   0.681  -0.585  1.00  0.00           H  
HETATM   32  H   UNL     1       3.310   0.449  -1.634  1.00  0.00           H  
HETATM   33  H   UNL     1       1.899   0.450   1.726  1.00  0.00           H  
HETATM   34  H   UNL     1       3.088   1.561   1.004  1.00  0.00           H  
HETATM   35  H   UNL     1       1.840   1.415  -1.179  1.00  0.00           H  
HETATM   36  H   UNL     1       0.377   2.315   1.367  1.00  0.00           H  
HETATM   37  H   UNL     1       0.775   4.416   0.303  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.613   2.523   0.136  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.739   2.950  -1.369  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.788   0.756  -2.036  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.828  -0.161  -2.374  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.939  -2.402  -2.047  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.128  -1.303  -1.308  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.148  -0.756  -2.690  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.412  -0.626   2.351  1.00  0.00           H  
CONECT    1    2    6   23   24                                       
CONECT    2    1    3   25   26                                       
CONECT    3    2    4   27   28                                       
CONECT    4    3    5   29   30                                       
CONECT    5    4    6   31   32                                       
CONECT    6    1    5    7                                            
CONECT    7    6    8   33   34                                       
CONECT    8    7    9   10   35                                       
CONECT    9    8   13                                                 
CONECT   10    8   11   12   36                                       
CONECT   11   10   37                                                 
CONECT   12   10   13   38   39                                       
CONECT   13    9   12   14   40                                       
CONECT   14   13   15   21                                            
CONECT   15   14   16   16   41                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16   42   43   44                                       
CONECT   18   16   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   21   45                                            
CONECT   21   14   20   22   22                                       
CONECT   22   21   21                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
