COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.234   2.622  -0.235  1.00  0.00           C  
HETATM    2  C   UNL     1       0.131   3.927   0.511  1.00  0.00           C  
HETATM    3  C   UNL     1       0.199   0.186  -0.291  1.00  0.00           C  
HETATM    4  C   UNL     1       1.361  -0.688   0.185  1.00  0.00           C  
HETATM    5  C   UNL     1       2.683   0.037  -0.072  1.00  0.00           C  
HETATM    6  C   UNL     1       3.849  -0.885   0.289  1.00  0.00           C  
HETATM    7  C   UNL     1       5.172  -0.160   0.031  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.124  -0.539  -0.034  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.287   0.350  -0.479  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.583  -0.404  -0.322  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.385  -0.245   0.905  1.00  0.00           C  
HETATM   12  N   UNL     1       0.210   1.456   0.440  1.00  0.00           N  
HETATM   13  N   UNL     1      -3.991  -1.190  -1.265  1.00  0.00           N  
HETATM   14  O   UNL     1       0.334   2.621  -1.444  1.00  0.00           O  
HETATM   15  O   UNL     1       1.349  -1.926  -0.528  1.00  0.00           O  
HETATM   16  O   UNL     1       2.769   0.396  -1.453  1.00  0.00           O  
HETATM   17  O   UNL     1       3.763  -1.243   1.669  1.00  0.00           O  
HETATM   18  O   UNL     1       6.259  -1.059   0.256  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.247  -0.822   1.361  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.544  -0.919   1.044  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.002   0.493   1.790  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.172  -1.425  -2.395  1.00  0.00           O  
HETATM   23  H   UNL     1       1.129   4.272   0.780  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.352   4.671  -0.122  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.459   3.782   1.416  1.00  0.00           H  
HETATM   26  H   UNL     1       0.305   0.381  -1.359  1.00  0.00           H  
HETATM   27  H   UNL     1       1.255  -0.882   1.253  1.00  0.00           H  
HETATM   28  H   UNL     1       2.729   0.938   0.540  1.00  0.00           H  
HETATM   29  H   UNL     1       3.803  -1.786  -0.324  1.00  0.00           H  
HETATM   30  H   UNL     1       5.199   0.191  -1.001  1.00  0.00           H  
HETATM   31  H   UNL     1       5.257   0.691   0.707  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.143  -1.471  -0.597  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.314   1.249   0.137  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.153   0.628  -1.524  1.00  0.00           H  
HETATM   35  H   UNL     1       0.201   1.457   1.410  1.00  0.00           H  
HETATM   36  H   UNL     1       1.440  -1.829  -1.486  1.00  0.00           H  
HETATM   37  H   UNL     1       2.734  -0.358  -2.058  1.00  0.00           H  
HETATM   38  H   UNL     1       3.798  -0.490   2.274  1.00  0.00           H  
HETATM   39  H   UNL     1       7.131  -0.666   0.111  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.316  -0.035   1.918  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.035  -0.783   1.866  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.561  -2.026  -3.046  1.00  0.00           H  
CONECT    1    2   14   14   12                                       
CONECT    2    1   23   24   25                                       
CONECT    3   12    8    4   26                                       
CONECT    4    3    5   15   27                                       
CONECT    5    4   16    6   28                                       
CONECT    6    5   17    7   29                                       
CONECT    7    6   18   30   31                                       
CONECT    8    9   19    3   32                                       
CONECT    9   10    8   33   34                                       
CONECT   10   13   13   11    9                                       
CONECT   11   21   21   10   20                                       
CONECT   12    1    3   35                                            
CONECT   13   22   10   10                                            
CONECT   14    1    1                                                 
CONECT   15    4   36                                                 
CONECT   16    5   37                                                 
CONECT   17    6   38                                                 
CONECT   18    7   39                                                 
CONECT   19    8   40                                                 
CONECT   20   11   41                                                 
CONECT   21   11   11                                                 
CONECT   22   13   42                                                 
CONECT   23    2                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
