COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.700   0.279  -2.676  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.058  -0.001  -1.363  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.071  -0.264  -0.409  1.00  0.00           C  
HETATM    4  C   UNL     1       1.261  -0.256  -0.775  1.00  0.00           C  
HETATM    5  C   UNL     1       1.618   0.021  -2.097  1.00  0.00           C  
HETATM    6  C   UNL     1       0.626   0.288  -3.045  1.00  0.00           C  
HETATM    7  C   UNL     1       3.039   0.031  -2.492  1.00  0.00           C  
HETATM    8  O   UNL     1       3.381   0.299  -3.768  1.00  0.00           O  
HETATM    9  O   UNL     1       3.900  -0.200  -1.668  1.00  0.00           O  
HETATM   10  N   UNL     1      -0.433  -0.542   0.914  1.00  0.00           N  
HETATM   11  C   UNL     1       0.389  -0.197   1.924  1.00  0.00           C  
HETATM   12  C   UNL     1       0.039  -0.569   3.342  1.00  0.00           C  
HETATM   13  O   UNL     1       1.411   0.412   1.692  1.00  0.00           O  
HETATM   14  C   UNL     1       1.217  -0.239   4.261  1.00  0.00           C  
HETATM   15  C   UNL     1       0.862  -0.616   5.701  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.192   0.221   3.788  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.898   1.720   3.691  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.403  -0.009  -0.994  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.359  -0.146  -1.934  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.812  -0.005  -1.558  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.051  -0.382  -3.083  1.00  0.00           O  
HETATM   22  H   UNL     1      -1.465   0.487  -3.410  1.00  0.00           H  
HETATM   23  H   UNL     1       2.025  -0.463  -0.040  1.00  0.00           H  
HETATM   24  H   UNL     1       0.900   0.503  -4.068  1.00  0.00           H  
HETATM   25  H   UNL     1       4.313   0.306  -4.027  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.276  -0.982   1.105  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.175  -1.636   3.395  1.00  0.00           H  
HETATM   28  H   UNL     1       1.432   0.828   4.208  1.00  0.00           H  
HETATM   29  H   UNL     1       2.094  -0.802   3.944  1.00  0.00           H  
HETATM   30  H   UNL     1       1.701  -0.382   6.356  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.015  -0.053   6.018  1.00  0.00           H  
HETATM   32  H   UNL     1       0.647  -1.684   5.754  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.035  -0.025   3.143  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.435  -0.035   4.819  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.781   2.283   3.994  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.064   1.970   4.347  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.641   1.974   2.663  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.651   0.082  -0.060  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.432  -0.147  -2.443  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.068  -0.757  -0.811  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.986   0.988  -1.147  1.00  0.00           H  
CONECT    1    2    2    6   22                                       
CONECT    2    1    1    3   18                                       
CONECT    3    2    4    4   10                                       
CONECT    4    3    3    5   23                                       
CONECT    5    4    6    6    7                                       
CONECT    6    1    5    5   24                                       
CONECT    7    5    8    9    9                                       
CONECT    8    7   25                                                 
CONECT    9    7    7                                                 
CONECT   10    3   11   26                                            
CONECT   11   10   12   13   13                                       
CONECT   12   11   14   16   27                                       
CONECT   13   11   11                                                 
CONECT   14   12   15   28   29                                       
CONECT   15   14   30   31   32                                       
CONECT   16   12   17   33   34                                       
CONECT   17   16   35   36   37                                       
CONECT   18    2   19   38                                            
CONECT   19   18   20   21   21                                       
CONECT   20   19   39   40   41                                       
CONECT   21   19   19                                                 
CONECT   22    1                                                      
CONECT   23    4                                                      
CONECT   24    6                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   12                                                      
CONECT   28   14                                                      
CONECT   29   14                                                      
CONECT   30   15                                                      
CONECT   31   15                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
