COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.583  -1.083  -2.091  1.00  0.00           O  
HETATM    2  C   UNL     1       1.587  -0.378  -1.104  1.00  0.00           C  
HETATM    3  C   UNL     1       2.860  -0.027  -0.455  1.00  0.00           C  
HETATM    4  C   UNL     1       4.068  -0.504  -0.973  1.00  0.00           C  
HETATM    5  C   UNL     1       5.257  -0.171  -0.358  1.00  0.00           C  
HETATM    6  C   UNL     1       5.256   0.634   0.768  1.00  0.00           C  
HETATM    7  C   UNL     1       6.560   0.993   1.433  1.00  0.00           C  
HETATM    8  C   UNL     1       4.064   1.110   1.287  1.00  0.00           C  
HETATM    9  C   UNL     1       2.868   0.790   0.680  1.00  0.00           C  
HETATM   10  C   UNL     1       0.287   0.144  -0.546  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.882  -0.471  -1.318  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.945  -1.983  -1.050  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.196  -2.259   0.432  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.445  -1.506   0.919  1.00  0.00           C  
HETATM   15  O   UNL     1      -2.606  -1.694   2.326  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.238  -0.029   0.614  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.436   0.854   0.983  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.644   0.092   0.964  1.00  0.00           O  
HETATM   19  N   UNL     1      -2.136   0.114  -0.862  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.306   1.558  -1.085  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.461   1.941  -0.122  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.712   1.917  -0.812  1.00  0.00           O  
HETATM   23  H   UNL     1       4.070  -1.132  -1.851  1.00  0.00           H  
HETATM   24  H   UNL     1       6.190  -0.538  -0.757  1.00  0.00           H  
HETATM   25  H   UNL     1       6.948   1.914   0.998  1.00  0.00           H  
HETATM   26  H   UNL     1       6.395   1.137   2.501  1.00  0.00           H  
HETATM   27  H   UNL     1       7.279   0.188   1.281  1.00  0.00           H  
HETATM   28  H   UNL     1       4.072   1.737   2.166  1.00  0.00           H  
HETATM   29  H   UNL     1       1.939   1.166   1.084  1.00  0.00           H  
HETATM   30  H   UNL     1       0.210  -0.126   0.507  1.00  0.00           H  
HETATM   31  H   UNL     1       0.258   1.229  -0.646  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.756  -0.291  -2.385  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.753  -2.418  -1.638  1.00  0.00           H  
HETATM   34  H   UNL     1       0.000  -2.439  -1.345  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.342  -3.329   0.579  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.332  -1.931   1.010  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.326  -1.873   0.393  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.713  -2.618   2.590  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.335   0.335   1.105  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.288   1.308   1.963  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.434   0.602   1.190  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.395   2.097  -0.825  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.588   1.756  -2.120  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.284   2.925   0.310  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.785   2.577  -1.516  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   10                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3    5   23                                       
CONECT    5    4    6    6   24                                       
CONECT    6    5    5    7    8                                       
CONECT    7    6   25   26   27                                       
CONECT    8    6    9    9   28                                       
CONECT    9    3    8    8   29                                       
CONECT   10    2   11   30   31                                       
CONECT   11   10   12   19   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   14   35   36                                       
CONECT   14   13   15   16   37                                       
CONECT   15   14   38                                                 
CONECT   16   14   17   19   39                                       
CONECT   17   16   18   21   40                                       
CONECT   18   17   41                                                 
CONECT   19   11   16   20                                            
CONECT   20   19   21   42   43                                       
CONECT   21   17   20   22   44                                       
CONECT   22   21   45                                                 
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
