COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.802   0.696  -1.079  1.00  0.00           C  
HETATM    2  C   UNL     1       5.001   0.434  -0.004  1.00  0.00           C  
HETATM    3  C   UNL     1       3.592  -0.034  -0.003  1.00  0.00           C  
HETATM    4  C   UNL     1       2.547   0.898  -0.007  1.00  0.00           C  
HETATM    5  C   UNL     1       1.709   3.124  -0.016  1.00  0.00           C  
HETATM    6  C   UNL     1       1.237   0.466  -0.007  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.007   1.632   0.003  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.304   4.002  -0.007  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.683   3.830  -0.005  1.00  0.00           C  
HETATM   10  C   UNL     1       3.316  -1.396  -0.003  1.00  0.00           C  
HETATM   11  C   UNL     1       5.834   0.715   1.115  1.00  0.00           C  
HETATM   12  C   UNL     1       5.464   0.598   2.571  1.00  0.00           C  
HETATM   13  N   UNL     1       6.980   1.094   0.629  1.00  0.00           N  
HETATM   14  O   UNL     1       6.982   1.090  -0.579  1.00  0.00           O  
HETATM   15  C   UNL     1       5.436   0.562  -2.534  1.00  0.00           C  
HETATM   16  C   UNL     1       1.999  -1.838  -0.003  1.00  0.00           C  
HETATM   17  N   UNL     1       1.443  -3.109  -0.003  1.00  0.00           N  
HETATM   18  C   UNL     1       0.072  -3.031  -0.002  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.894  -3.949   0.000  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.161  -3.595   0.001  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.214  -4.674   0.002  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.548  -2.334   0.002  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.656  -1.346   0.001  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.295  -1.676  -0.001  1.00  0.00           C  
HETATM   25  C   UNL     1       0.954  -0.900  -0.002  1.00  0.00           C  
HETATM   26  O   UNL     1       2.824   2.229  -0.012  1.00  0.00           O  
HETATM   27  N   UNL     1      -2.064  -0.023   0.001  1.00  0.00           N  
HETATM   28  C   UNL     1      -3.428   0.288   0.002  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.469   2.922  -0.003  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.232   2.579   0.007  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.405   1.459   0.005  1.00  0.00           C  
HETATM   32  N   UNL     1      -5.637   0.108   0.006  1.00  0.00           N  
HETATM   33  N   UNL     1      -4.414  -0.569   0.004  1.00  0.00           N  
HETATM   34  C   UNL     1      -6.958  -0.525   0.009  1.00  0.00           C  
HETATM   35  H   UNL     1       1.105   2.947  -0.906  1.00  0.00           H  
HETATM   36  H   UNL     1       1.103   2.954   0.873  1.00  0.00           H  
HETATM   37  H   UNL     1       2.069   4.153  -0.020  1.00  0.00           H  
HETATM   38  H   UNL     1       0.430   1.185  -0.010  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.889   4.999  -0.017  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.328   4.696  -0.012  1.00  0.00           H  
HETATM   41  H   UNL     1       4.125  -2.111  -0.004  1.00  0.00           H  
HETATM   42  H   UNL     1       5.699  -0.406   2.925  1.00  0.00           H  
HETATM   43  H   UNL     1       6.028   1.329   3.149  1.00  0.00           H  
HETATM   44  H   UNL     1       4.397   0.785   2.690  1.00  0.00           H  
HETATM   45  H   UNL     1       5.020   1.504  -2.892  1.00  0.00           H  
HETATM   46  H   UNL     1       6.326   0.315  -3.112  1.00  0.00           H  
HETATM   47  H   UNL     1       4.696  -0.230  -2.651  1.00  0.00           H  
HETATM   48  H   UNL     1       1.950  -3.936  -0.003  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.466  -4.934   1.030  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.105  -4.313  -0.511  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.831  -5.556  -0.512  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.405   0.688   0.000  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.398   3.063  -0.005  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.305   2.460   0.009  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.288  -0.683  -1.018  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.900  -1.485   0.523  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.670   0.120   0.524  1.00  0.00           H  
CONECT    1   14   15    2    2                                       
CONECT    2    1    1   11    3                                       
CONECT    3    2   10   10    4                                       
CONECT    4    3   26    6    6                                       
CONECT    5   26   35   36   37                                       
CONECT    6    4    4   25   38                                       
CONECT    7   29   29   28   31                                       
CONECT    8   29    9    9   39                                       
CONECT    9    8    8   30   40                                       
CONECT   10    3    3   16   41                                       
CONECT   11   13   13   12    2                                       
CONECT   12   11   42   43   44                                       
CONECT   13   14   11   11                                            
CONECT   14   13    1                                                 
CONECT   15    1   45   46   47                                       
CONECT   16   10   17   25   25                                       
CONECT   17   16   18   48                                            
CONECT   18   17   19   19   24                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   22   22                                       
CONECT   21   20   49   50   51                                       
CONECT   22   20   20   23                                            
CONECT   23   24   24   22   27                                       
CONECT   24   18   25   23   23                                       
CONECT   25   16   16   24    6                                       
CONECT   26    4    5                                                 
CONECT   27   23   28   52                                            
CONECT   28   27    7   33   33                                       
CONECT   29    7    7    8   53                                       
CONECT   30   31   31    9   54                                       
CONECT   31    7   32   30   30                                       
CONECT   32   33   31   34                                            
CONECT   33   28   28   32                                            
CONECT   34   32   55   56   57                                       
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   12                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   17                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
