COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.721   1.017  -0.606  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.700   1.357   0.162  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.269   0.472   1.225  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.888  -0.978   1.016  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.455  -1.176   0.602  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.013  -0.295  -0.568  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.537  -0.846   1.652  1.00  0.00           O  
HETATM    8  C   UNL     1       1.815  -0.116   1.760  1.00  0.00           C  
HETATM    9  C   UNL     1       2.837   0.431   0.994  1.00  0.00           C  
HETATM   10  C   UNL     1       2.675   0.693  -0.344  1.00  0.00           C  
HETATM   11  C   UNL     1       1.483   0.671  -2.493  1.00  0.00           C  
HETATM   12  N   UNL     1       0.779  -0.348  -3.241  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.637  -0.272  -3.043  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.160  -1.051  -1.873  1.00  0.00           C  
HETATM   15  C   UNL     1       0.603  -0.369   1.106  1.00  0.00           C  
HETATM   16  C   UNL     1       0.455  -0.063  -0.252  1.00  0.00           C  
HETATM   17  C   UNL     1       1.468   0.432  -1.012  1.00  0.00           C  
HETATM   18  C   UNL     1       3.325  -0.026   3.412  1.00  0.00           C  
HETATM   19  O   UNL     1       1.986  -0.399   3.080  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.781   0.902   2.497  1.00  0.00           O  
HETATM   21  C   UNL     1       1.021  -0.072  -4.663  1.00  0.00           C  
HETATM   22  H   UNL     1      -1.387   1.740  -1.335  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.134   2.337   0.030  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.356   0.559   1.214  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.060  -1.520   1.946  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.535  -1.400   0.247  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.308  -2.218   0.318  1.00  0.00           H  
HETATM   28  H   UNL     1       3.783   0.657   1.464  1.00  0.00           H  
HETATM   29  H   UNL     1       3.501   1.113  -0.899  1.00  0.00           H  
HETATM   30  H   UNL     1       1.021   1.637  -2.696  1.00  0.00           H  
HETATM   31  H   UNL     1       2.519   0.703  -2.832  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.908   0.774  -2.907  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.129  -0.635  -3.945  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.216  -1.270  -2.038  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.614  -1.991  -1.801  1.00  0.00           H  
HETATM   36  H   UNL     1       3.509  -0.235   4.466  1.00  0.00           H  
HETATM   37  H   UNL     1       4.023  -0.597   2.801  1.00  0.00           H  
HETATM   38  H   UNL     1       3.463   1.038   3.223  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.072   1.816   2.615  1.00  0.00           H  
HETATM   40  H   UNL     1       0.547   0.870  -4.936  1.00  0.00           H  
HETATM   41  H   UNL     1       2.094  -0.004  -4.843  1.00  0.00           H  
HETATM   42  H   UNL     1       0.602  -0.877  -5.267  1.00  0.00           H  
CONECT    1    2    2    6   22                                       
CONECT    2    1    1    3   23                                       
CONECT    3    2    4   20   24                                       
CONECT    4    3    5   25   26                                       
CONECT    5    4    6    7   27                                       
CONECT    6    1    5   14   16                                       
CONECT    7    5   15                                                 
CONECT    8    9    9   15   19                                       
CONECT    9    8    8   10   28                                       
CONECT   10    9   17   17   29                                       
CONECT   11   12   17   30   31                                       
CONECT   12   11   13   21                                            
CONECT   13   12   14   32   33                                       
CONECT   14    6   13   34   35                                       
CONECT   15    7    8   16   16                                       
CONECT   16    6   15   15   17                                       
CONECT   17   10   10   11   16                                       
CONECT   18   19   36   37   38                                       
CONECT   19    8   18                                                 
CONECT   20    3   39                                                 
CONECT   21   12   40   41   42                                       
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
