COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.462   4.286  -0.918  1.00  0.00           C  
HETATM    2  C   UNL     1       2.427   3.046  -0.062  1.00  0.00           C  
HETATM    3  O   UNL     1       2.972   3.041   1.021  1.00  0.00           O  
HETATM    4  N   UNL     1       1.790   1.942  -0.501  1.00  0.00           N  
HETATM    5  C   UNL     1       1.755   0.737   0.331  1.00  0.00           C  
HETATM    6  C   UNL     1       3.024  -0.088   0.090  1.00  0.00           C  
HETATM    7  O   UNL     1       4.168   0.664   0.502  1.00  0.00           O  
HETATM    8  C   UNL     1       2.941  -1.382   0.905  1.00  0.00           C  
HETATM    9  C   UNL     1       1.671  -2.142   0.514  1.00  0.00           C  
HETATM   10  C   UNL     1       1.742  -2.523  -0.942  1.00  0.00           C  
HETATM   11  O   UNL     1       1.953  -1.579  -1.874  1.00  0.00           O  
HETATM   12  O   UNL     1       1.610  -3.678  -1.272  1.00  0.00           O  
HETATM   13  O   UNL     1       1.558  -3.323   1.310  1.00  0.00           O  
HETATM   14  O   UNL     1       0.531  -1.308   0.733  1.00  0.00           O  
HETATM   15  C   UNL     1       0.531  -0.105  -0.039  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.742   0.690   0.255  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.742   1.893  -0.515  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.965  -0.152  -0.114  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.966  -1.355   0.657  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.239   0.643   0.180  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.411  -0.163  -0.173  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.650   0.337   0.002  1.00  0.00           C  
HETATM   23  O   UNL     1      -5.796   1.454   0.452  1.00  0.00           O  
HETATM   24  C   UNL     1      -6.855  -0.492  -0.362  1.00  0.00           C  
HETATM   25  H   UNL     1       3.341   4.257  -1.563  1.00  0.00           H  
HETATM   26  H   UNL     1       1.562   4.330  -1.531  1.00  0.00           H  
HETATM   27  H   UNL     1       2.510   5.167  -0.279  1.00  0.00           H  
HETATM   28  H   UNL     1       1.354   1.946  -1.368  1.00  0.00           H  
HETATM   29  H   UNL     1       1.699   1.021   1.382  1.00  0.00           H  
HETATM   30  H   UNL     1       3.106  -0.329  -0.970  1.00  0.00           H  
HETATM   31  H   UNL     1       5.007   0.199   0.384  1.00  0.00           H  
HETATM   32  H   UNL     1       3.814  -2.000   0.697  1.00  0.00           H  
HETATM   33  H   UNL     1       2.908  -1.141   1.968  1.00  0.00           H  
HETATM   34  H   UNL     1       1.991  -1.872  -2.795  1.00  0.00           H  
HETATM   35  H   UNL     1       0.774  -3.855   1.116  1.00  0.00           H  
HETATM   36  H   UNL     1       0.568  -0.354  -1.099  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.779   0.938   1.316  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.710   1.748  -1.471  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.929  -0.400  -1.175  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.998  -1.210   1.613  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.276   0.891   1.241  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.239   1.561  -0.408  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.294  -1.056  -0.533  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.528  -1.458  -0.747  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.472  -0.643   0.523  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.435   0.026  -1.125  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    4    1    3    3                                       
CONECT    3    2    2                                                 
CONECT    4    5    2   28                                            
CONECT    5    6    4   15   29                                       
CONECT    6    7    8    5   30                                       
CONECT    7    6   31                                                 
CONECT    8    6    9   32   33                                       
CONECT    9   10    8   13   14                                       
CONECT   10   12   12   11    9                                       
CONECT   11   10   34                                                 
CONECT   12   10   10                                                 
CONECT   13    9   35                                                 
CONECT   14    9   15                                                 
CONECT   15    5   14   16   36                                       
CONECT   16   15   18   17   37                                       
CONECT   17   16   38                                                 
CONECT   18   19   16   20   39                                       
CONECT   19   18   40                                                 
CONECT   20   18   21   41   42                                       
CONECT   21   20   22   43                                            
CONECT   22   21   24   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   22   44   45   46                                       
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   13                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
