COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.865   0.005  -2.252  1.00  0.00           C  
HETATM    2  C   UNL     1      10.354  -0.162  -2.073  1.00  0.00           C  
HETATM    3  O   UNL     1       9.960   0.388  -0.815  1.00  0.00           O  
HETATM    4  N   UNL     1       8.573   0.284  -0.550  1.00  0.00           N  
HETATM    5  C   UNL     1       8.090   0.746   0.558  1.00  0.00           C  
HETATM    6  C   UNL     1       6.644   0.637   0.834  1.00  0.00           C  
HETATM    7  C   UNL     1       6.120   1.135   2.030  1.00  0.00           C  
HETATM    8  C   UNL     1       4.770   1.032   2.283  1.00  0.00           C  
HETATM    9  C   UNL     1       5.795   0.041  -0.102  1.00  0.00           C  
HETATM   10  C   UNL     1       4.446  -0.058   0.160  1.00  0.00           C  
HETATM   11  C   UNL     1       3.930   0.433   1.353  1.00  0.00           C  
HETATM   12  O   UNL     1       2.600   0.333   1.607  1.00  0.00           O  
HETATM   13  C   UNL     1       1.794  -0.294   0.607  1.00  0.00           C  
HETATM   14  C   UNL     1       0.335  -0.315   1.068  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.528  -0.986  -0.003  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.125  -2.455  -0.136  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.002  -0.896   0.400  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.873  -1.454  -0.726  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.284  -1.369  -0.340  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.093  -0.329  -0.582  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.727   0.675  -1.162  1.00  0.00           O  
HETATM   22  C   UNL     1      -5.039  -2.413   0.368  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.450  -1.812   0.517  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.342  -0.495  -0.128  1.00  0.00           N  
HETATM   25  C   UNL     1      -7.377   0.433  -0.249  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.169   1.657  -0.884  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.218   2.547  -0.983  1.00  0.00           C  
HETATM   28  N   UNL     1      -9.404   2.253  -0.486  1.00  0.00           N  
HETATM   29  C   UNL     1      -9.641   1.105   0.122  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.646   0.159   0.257  1.00  0.00           C  
HETATM   31  H   UNL     1      12.119   1.065  -2.224  1.00  0.00           H  
HETATM   32  H   UNL     1      12.386  -0.515  -1.449  1.00  0.00           H  
HETATM   33  H   UNL     1      12.165  -0.415  -3.212  1.00  0.00           H  
HETATM   34  H   UNL     1       9.833   0.358  -2.877  1.00  0.00           H  
HETATM   35  H   UNL     1      10.100  -1.222  -2.102  1.00  0.00           H  
HETATM   36  H   UNL     1       8.744   1.211   1.281  1.00  0.00           H  
HETATM   37  H   UNL     1       6.773   1.600   2.754  1.00  0.00           H  
HETATM   38  H   UNL     1       6.196  -0.341  -1.029  1.00  0.00           H  
HETATM   39  H   UNL     1       4.364   1.416   3.207  1.00  0.00           H  
HETATM   40  H   UNL     1       3.789  -0.518  -0.563  1.00  0.00           H  
HETATM   41  H   UNL     1       1.872   0.265  -0.326  1.00  0.00           H  
HETATM   42  H   UNL     1       2.139  -1.315   0.449  1.00  0.00           H  
HETATM   43  H   UNL     1       0.256  -0.873   2.000  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.011   0.707   1.226  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.381  -0.481  -0.957  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.272  -2.961   0.819  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.740  -2.933  -0.898  1.00  0.00           H  
HETATM   48  H   UNL     1       0.925  -2.519  -0.423  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.166  -1.476   1.308  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.266   0.146   0.582  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.709  -0.875  -1.634  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.609  -2.496  -0.908  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.073  -3.328  -0.223  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.600  -2.605   1.347  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.185  -2.429  -0.001  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.712  -1.706   1.569  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.200   1.904  -1.292  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.848  -0.780   0.751  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.066   3.497  -1.474  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.626   0.903   0.515  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4                                                 
CONECT    4    3    5    5                                            
CONECT    5    4    4    6   36                                       
CONECT    6    5    7    9    9                                       
CONECT    7    6    8    8   37                                       
CONECT    8    7    7   11   39                                       
CONECT    9    6    6   10   38                                       
CONECT   10    9   11   11   40                                       
CONECT   11    8   10   10   12                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   41   42                                       
CONECT   14   13   15   43   44                                       
CONECT   15   14   16   17   45                                       
CONECT   16   15   46   47   48                                       
CONECT   17   15   18   49   50                                       
CONECT   18   17   19   51   52                                       
CONECT   19   18   20   22                                            
CONECT   20   19   21   21   24                                       
CONECT   21   20   20                                                 
CONECT   22   19   23   53   54                                       
CONECT   23   22   24   55   56                                       
CONECT   24   20   23   25                                            
CONECT   25   24   26   26   30                                       
CONECT   26   25   25   27   57                                       
CONECT   27   26   28   28   59                                       
CONECT   28   27   27   29                                            
CONECT   29   28   30   30   60                                       
CONECT   30   25   29   29   58                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    9                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   23                                                      
CONECT   57   26                                                      
CONECT   58   30                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
