COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.754   0.192  -0.951  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.787   1.330  -0.560  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.302   0.214   0.147  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.127  -0.903   0.262  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.657  -2.125   1.008  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.904  -3.050   0.050  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.804   0.235   2.139  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.422   0.243   1.892  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.819   0.229  -0.062  1.00  0.00           C  
HETATM   10  C   UNL     1       0.816   0.218   0.377  1.00  0.00           C  
HETATM   11  C   UNL     1       3.291   0.204   0.035  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.949   0.226   0.753  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.543   0.246   2.701  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.558   0.229   0.510  1.00  0.00           C  
HETATM   15  N   UNL     1      -7.328  -0.876  -0.293  1.00  0.00           N  
HETATM   16  C   UNL     1       1.933   0.202  -0.669  1.00  0.00           C  
HETATM   17  C   UNL     1       8.135   0.188   0.442  1.00  0.00           C  
HETATM   18  C   UNL     1       6.275  -1.001  -0.226  1.00  0.00           C  
HETATM   19  C   UNL     1       6.294   1.391  -0.248  1.00  0.00           C  
HETATM   20  C   UNL     1       5.614   0.188  -0.479  1.00  0.00           C  
HETATM   21  N   UNL     1      -7.005   1.276  -1.087  1.00  0.00           N  
HETATM   22  C   UNL     1       5.587  -2.321  -0.459  1.00  0.00           C  
HETATM   23  N   UNL     1       9.436   0.181   0.923  1.00  0.00           N  
HETATM   24  N   UNL     1       7.521  -0.965   0.229  1.00  0.00           N  
HETATM   25  C   UNL     1       5.844  -2.783  -1.894  1.00  0.00           C  
HETATM   26  N   UNL     1       7.539   1.348   0.212  1.00  0.00           N  
HETATM   27  N   UNL     1       5.673   2.608  -0.487  1.00  0.00           N  
HETATM   28  O   UNL     1       4.334   0.189  -0.942  1.00  0.00           O  
HETATM   29  O   UNL     1      -0.453   0.217  -0.281  1.00  0.00           O  
HETATM   30  N   UNL     1      -5.009   2.464  -0.704  1.00  0.00           N  
HETATM   31  N   UNL     1      -9.015   0.171  -1.520  1.00  0.00           N  
HETATM   32  H   UNL     1      -4.994  -1.823   1.819  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.518  -2.651   1.421  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.539  -3.282  -0.805  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.997  -2.554  -0.295  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.640  -3.972   0.568  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.678   0.237   2.773  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.438   0.252   2.336  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.926   0.218  -1.137  1.00  0.00           H  
HETATM   40  H   UNL     1       0.898  -0.666   1.010  1.00  0.00           H  
HETATM   41  H   UNL     1       0.906   1.114   0.991  1.00  0.00           H  
HETATM   42  H   UNL     1       3.381   1.100   0.649  1.00  0.00           H  
HETATM   43  H   UNL     1       3.373  -0.680   0.668  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.432   0.257   3.775  1.00  0.00           H  
HETATM   45  H   UNL     1       1.843  -0.694  -1.283  1.00  0.00           H  
HETATM   46  H   UNL     1       1.850   1.086  -1.301  1.00  0.00           H  
HETATM   47  H   UNL     1       5.977  -3.062   0.238  1.00  0.00           H  
HETATM   48  H   UNL     1       4.514  -2.204  -0.301  1.00  0.00           H  
HETATM   49  H   UNL     1       9.896   1.018   1.087  1.00  0.00           H  
HETATM   50  H   UNL     1       9.884  -0.662   1.095  1.00  0.00           H  
HETATM   51  H   UNL     1       5.453  -2.042  -2.591  1.00  0.00           H  
HETATM   52  H   UNL     1       6.916  -2.900  -2.052  1.00  0.00           H  
HETATM   53  H   UNL     1       5.345  -3.738  -2.063  1.00  0.00           H  
HETATM   54  H   UNL     1       4.760   2.631  -0.817  1.00  0.00           H  
HETATM   55  H   UNL     1       6.150   3.437  -0.325  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.120   2.495  -0.317  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.351   3.229  -1.193  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.574  -0.617  -1.432  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.341   0.945  -2.005  1.00  0.00           H  
CONECT    1   31   15   15   21                                       
CONECT    2   21   21    3   30                                       
CONECT    3    4    4    2   12                                       
CONECT    4   15    5    3    3                                       
CONECT    5    6    4   32   33                                       
CONECT    6    5   34   35   36                                       
CONECT    7   12   12   13   37                                       
CONECT    8   13   13   14   38                                       
CONECT    9   12   14   14   39                                       
CONECT   10   29   16   40   41                                       
CONECT   11   28   16   42   43                                       
CONECT   12    3    7    7    9                                       
CONECT   13    7    8    8   44                                       
CONECT   14    9    9    8   29                                       
CONECT   15    1    1    4                                            
CONECT   16   11   10   45   46                                       
CONECT   17   23   24   24   26                                       
CONECT   18   24   22   20   20                                       
CONECT   19   26   26   20   27                                       
CONECT   20   18   18   19   28                                       
CONECT   21    1    2    2                                            
CONECT   22   25   18   47   48                                       
CONECT   23   17   49   50                                            
CONECT   24   17   17   18                                            
CONECT   25   22   51   52   53                                       
CONECT   26   17   19   19                                            
CONECT   27   19   54   55                                            
CONECT   28   20   11                                                 
CONECT   29   14   10                                                 
CONECT   30    2   56   57                                            
CONECT   31    1   58   59                                            
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   27                                                      
CONECT   55   27                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
