COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.056   1.754   0.812  1.00  0.00           C  
HETATM    2  N   UNL     1       6.589   1.699   0.874  1.00  0.00           N  
HETATM    3  C   UNL     1       6.013   1.509  -0.464  1.00  0.00           C  
HETATM    4  C   UNL     1       4.510   1.458  -0.361  1.00  0.00           C  
HETATM    5  C   UNL     1       3.773   2.624  -0.461  1.00  0.00           C  
HETATM    6  C   UNL     1       2.396   2.582  -0.368  1.00  0.00           C  
HETATM    7  C   UNL     1       1.750   1.363  -0.173  1.00  0.00           C  
HETATM    8  C   UNL     1       2.498   0.192  -0.074  1.00  0.00           C  
HETATM    9  C   UNL     1       3.874   0.244  -0.173  1.00  0.00           C  
HETATM   10  C   UNL     1       0.271   1.312  -0.072  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.477   2.485  -0.171  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.850   2.431  -0.077  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.491   1.212   0.118  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.889   1.186   0.205  1.00  0.00           N  
HETATM   15  C   UNL     1      -4.548  -0.031   0.699  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.037   0.007   0.349  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.884  -1.234   0.015  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.416  -1.292   0.435  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.725  -2.310  -0.361  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.616  -2.905   0.122  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.189  -2.596   1.217  1.00  0.00           O  
HETATM   22  O   UNL     1       0.018  -3.840  -0.609  1.00  0.00           O  
HETATM   23  C   UNL     1       1.207  -4.438  -0.027  1.00  0.00           C  
HETATM   24  C   UNL     1       1.357  -5.873  -0.536  1.00  0.00           C  
HETATM   25  C   UNL     1       2.437  -3.622  -0.429  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.752   0.043   0.219  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.374   0.093   0.117  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.619   2.260  -0.157  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.949   3.436  -0.820  1.00  0.00           C  
HETATM   30  O   UNL     1      -5.813   2.280   0.050  1.00  0.00           O  
HETATM   31  H   UNL     1       8.456   1.895   1.816  1.00  0.00           H  
HETATM   32  H   UNL     1       8.437   0.822   0.397  1.00  0.00           H  
HETATM   33  H   UNL     1       8.362   2.587   0.179  1.00  0.00           H  
HETATM   34  H   UNL     1       6.280   0.976   1.506  1.00  0.00           H  
HETATM   35  H   UNL     1       6.305   2.340  -1.107  1.00  0.00           H  
HETATM   36  H   UNL     1       6.380   0.575  -0.889  1.00  0.00           H  
HETATM   37  H   UNL     1       4.274   3.568  -0.612  1.00  0.00           H  
HETATM   38  H   UNL     1       4.455  -0.663  -0.100  1.00  0.00           H  
HETATM   39  H   UNL     1       1.821   3.493  -0.445  1.00  0.00           H  
HETATM   40  H   UNL     1       2.003  -0.756   0.078  1.00  0.00           H  
HETATM   41  H   UNL     1       0.020   3.433  -0.321  1.00  0.00           H  
HETATM   42  H   UNL     1       0.205  -0.816   0.189  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.431   3.339  -0.154  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.424  -0.106   1.779  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.156   0.248  -0.707  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.483  -0.967   0.552  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.533   0.767   0.953  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.388  -2.151   0.319  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.950  -1.120  -1.067  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.354  -1.558   1.490  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.067  -2.556  -1.235  1.00  0.00           H  
HETATM   52  H   UNL     1       1.114  -4.446   1.059  1.00  0.00           H  
HETATM   53  H   UNL     1       1.449  -5.865  -1.622  1.00  0.00           H  
HETATM   54  H   UNL     1       2.249  -6.322  -0.099  1.00  0.00           H  
HETATM   55  H   UNL     1       0.480  -6.454  -0.250  1.00  0.00           H  
HETATM   56  H   UNL     1       2.330  -2.600  -0.066  1.00  0.00           H  
HETATM   57  H   UNL     1       3.329  -4.071   0.008  1.00  0.00           H  
HETATM   58  H   UNL     1       2.529  -3.615  -1.515  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.095   3.088  -1.401  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.659   3.934  -1.480  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.608   4.137  -0.058  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34                                            
CONECT    3    2    4   35   36                                       
CONECT    4    3    5    9    9                                       
CONECT    5    4    6    6   37                                       
CONECT    6    5    5    7   39                                       
CONECT    7    6    8    8   10                                       
CONECT    8    7    7    9   40                                       
CONECT    9    4    4    8   38                                       
CONECT   10    7   11   27   27                                       
CONECT   11   10   12   12   41                                       
CONECT   12   11   11   13   43                                       
CONECT   13   12   14   26   26                                       
CONECT   14   13   15   28                                            
CONECT   15   14   16   17   44                                       
CONECT   16   15   45   46   47                                       
CONECT   17   15   18   48   49                                       
CONECT   18   17   19   26   50                                       
CONECT   19   18   20   51                                            
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23                                                 
CONECT   23   22   24   25   52                                       
CONECT   24   23   53   54   55                                       
CONECT   25   23   56   57   58                                       
CONECT   26   13   13   18   27                                       
CONECT   27   10   10   26   42                                       
CONECT   28   14   29   30   30                                       
CONECT   29   28   59   60   61                                       
CONECT   30   28   28                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   27                                                      
CONECT   43   12                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
