COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.694  -2.169  -0.965  1.00  0.00           C  
HETATM    2  C   UNL     1       2.777  -0.716  -1.360  1.00  0.00           C  
HETATM    3  C   UNL     1       2.710   0.732   0.723  1.00  0.00           C  
HETATM    4  C   UNL     1       3.755   1.734   0.200  1.00  0.00           C  
HETATM    5  C   UNL     1       5.126   1.250   0.717  1.00  0.00           C  
HETATM    6  C   UNL     1       4.922  -0.265   0.973  1.00  0.00           C  
HETATM    7  C   UNL     1       3.481  -0.326   1.539  1.00  0.00           C  
HETATM    8  C   UNL     1       0.692   0.252  -0.555  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.068   1.178   0.360  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.985   2.231  -0.900  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.473   0.410   0.242  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.615   0.888  -0.411  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.831   0.184  -0.252  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.690  -1.338   1.136  1.00  0.00           C  
HETATM   15  N   UNL     1       2.021   0.094  -0.402  1.00  0.00           N  
HETATM   16  N   UNL     1       3.468   3.077   0.719  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.460   1.271  -0.084  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.253   2.005  -1.088  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.835  -0.922   0.525  1.00  0.00           N  
HETATM   20  N   UNL     1      -3.724  -2.464   1.919  1.00  0.00           N  
HETATM   21  N   UNL     1      -2.552  -0.696   0.991  1.00  0.00           N  
HETATM   22  O   UNL     1       1.980  -2.506  -0.051  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.850   0.565  -0.802  1.00  0.00           O  
HETATM   24  O   UNL     1       0.106  -0.350  -1.430  1.00  0.00           O  
HETATM   25  H   UNL     1       3.820  -0.400  -1.360  1.00  0.00           H  
HETATM   26  H   UNL     1       2.358  -0.586  -2.357  1.00  0.00           H  
HETATM   27  H   UNL     1       1.989   1.244   1.360  1.00  0.00           H  
HETATM   28  H   UNL     1       3.749   1.745  -0.889  1.00  0.00           H  
HETATM   29  H   UNL     1       5.896   1.409  -0.037  1.00  0.00           H  
HETATM   30  H   UNL     1       5.386   1.761   1.644  1.00  0.00           H  
HETATM   31  H   UNL     1       4.996  -0.826   0.041  1.00  0.00           H  
HETATM   32  H   UNL     1       5.641  -0.633   1.705  1.00  0.00           H  
HETATM   33  H   UNL     1       3.476  -0.068   2.598  1.00  0.00           H  
HETATM   34  H   UNL     1       3.051  -1.315   1.384  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.036   0.789   1.378  1.00  0.00           H  
HETATM   36  H   UNL     1       0.388   2.168   0.335  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.432   3.057  -1.322  1.00  0.00           H  
HETATM   38  H   UNL     1       4.145   3.747   0.386  1.00  0.00           H  
HETATM   39  H   UNL     1       2.530   3.364   0.482  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.658  -1.418   0.654  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.555  -2.952   2.032  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.917  -2.773   2.360  1.00  0.00           H  
HETATM   43  O   UNL     1       3.408  -3.088  -1.633  1.00  0.00           O  
HETATM   44  H   UNL     1       3.322  -4.006  -1.344  1.00  0.00           H  
CONECT    1   22   22    2   43                                       
CONECT    2    1   15   25   26                                       
CONECT    3    4    7   15   27                                       
CONECT    4    5   16    3   28                                       
CONECT    5    6    4   29   30                                       
CONECT    6    5    7   31   32                                       
CONECT    7    6    3   33   34                                       
CONECT    8   15    9   24   24                                       
CONECT    9    8   17   35   36                                       
CONECT   10   17   18   18   37                                       
CONECT   11   17   21   12   12                                       
CONECT   12   11   11   18   13                                       
CONECT   13   12   19   23   23                                       
CONECT   14   21   21   20   19                                       
CONECT   15    3    2    8                                            
CONECT   16    4   38   39                                            
CONECT   17    9   10   11                                            
CONECT   18   10   10   12                                            
CONECT   19   14   13   40                                            
CONECT   20   14   41   42                                            
CONECT   21   11   14   14                                            
CONECT   22    1    1                                                 
CONECT   23   13   13                                                 
CONECT   24    8    8                                                 
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43    1   44                                                 
CONECT   44   43                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
