COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.751  -1.424  -0.604  1.00  0.00           C  
HETATM    2  C   UNL     1       2.986  -0.409   0.170  1.00  0.00           C  
HETATM    3  C   UNL     1       3.412  -1.600  -2.042  1.00  0.00           C  
HETATM    4  C   UNL     1       2.449  -0.861  -2.606  1.00  0.00           C  
HETATM    5  C   UNL     1       2.028   0.314  -0.425  1.00  0.00           C  
HETATM    6  C   UNL     1       1.713   0.128  -1.832  1.00  0.00           C  
HETATM    7  C   UNL     1       0.750   0.862  -2.413  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.026   1.854  -1.739  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.021  -0.055   3.375  1.00  0.00           C  
HETATM   10  O   UNL     1       4.630  -2.094  -0.073  1.00  0.00           O  
HETATM   11  N   UNL     1      -0.624   1.175   3.618  1.00  0.00           N  
HETATM   12  C   UNL     1       0.237   3.189  -1.637  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.804   3.681  -0.900  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.626   2.630  -0.601  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.177   1.501  -1.100  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.265   1.543   1.034  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.228   1.185   2.074  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.008  -0.092   2.429  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.391   1.959   2.792  1.00  0.00           C  
HETATM   20  O   UNL     1       1.106   3.952  -2.021  1.00  0.00           O1-
HETATM   21  N   UNL     1      -4.024   3.181  -0.649  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.863   2.795   0.192  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.408   5.362   0.844  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.036   5.052  -0.487  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.657   6.653   1.183  1.00  0.00           O  
HETATM   26  O   UNL     1       0.233   4.590   1.541  1.00  0.00           O  
HETATM   27  H   UNL     1       3.228  -0.278   1.218  1.00  0.00           H  
HETATM   28  H   UNL     1       3.966  -2.339  -2.609  1.00  0.00           H  
HETATM   29  H   UNL     1       2.210  -0.997  -3.656  1.00  0.00           H  
HETATM   30  H   UNL     1       1.476   1.053   0.149  1.00  0.00           H  
HETATM   31  H   UNL     1       0.536   0.661  -3.459  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.640  -0.951   3.843  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.218   1.706   1.558  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.440   0.681   0.376  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.468  -0.923   2.080  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.278   3.034   2.779  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.122   2.715  -1.512  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.501   4.006  -0.397  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.752   3.636   0.910  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.118   5.207  -0.432  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.616   5.708  -1.257  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.262   6.886   2.050  1.00  0.00           H  
CONECT    1    2    3   10   10                                       
CONECT    2    1    5    5   27                                       
CONECT    3    1    4    4   28                                       
CONECT    4    3    3    6   29                                       
CONECT    5    2    2    6   30                                       
CONECT    6    4    5    7    7                                       
CONECT    7    6    6    8   31                                       
CONECT    8    7   12   12   15                                       
CONECT    9   11   11   18   32                                       
CONECT   10    1    1                                                 
CONECT   11    9    9   19                                            
CONECT   12    8    8   13   20                                       
CONECT   13   12   14   24                                            
CONECT   14   13   15   15   22                                       
CONECT   15    8   14   14                                            
CONECT   16   17   22   33   34                                       
CONECT   17   16   18   19   19                                       
CONECT   18    9   17   35                                            
CONECT   19   11   17   17   36                                       
CONECT   20   12                                                      
CONECT   21   22   37   38                                            
CONECT   22   14   16   21   39                                       
CONECT   23   24   26   26   25                                       
CONECT   24   13   23   40   41                                       
CONECT   25   23   42                                                 
CONECT   26   23   23                                                 
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
