COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.896   0.319   0.063  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.795   3.731   0.437  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.848   2.399   0.050  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.815  -2.387  -0.509  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.678  -1.560  -1.205  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.686   4.495   0.129  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.630   3.934  -0.564  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.680   2.607  -0.950  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.784   1.837  -0.640  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.993  -1.864   0.472  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.032  -0.513   0.760  1.00  0.00           C  
HETATM   12  C   UNL     1       3.637  -0.777  -1.339  1.00  0.00           C  
HETATM   13  C   UNL     1       3.961   0.551  -1.623  1.00  0.00           C  
HETATM   14  N   UNL     1       3.868   1.491  -0.699  1.00  0.00           N  
HETATM   15  C   UNL     1       3.464   1.210   0.533  1.00  0.00           C  
HETATM   16  C   UNL     1       3.121  -0.107   0.887  1.00  0.00           C  
HETATM   17  C   UNL     1       3.210  -1.116  -0.086  1.00  0.00           C  
HETATM   18  N   UNL     1       4.389   0.891  -2.901  1.00  0.00           N  
HETATM   19  C   UNL     1       2.854  -2.542   0.248  1.00  0.00           C  
HETATM   20  C   UNL     1       1.367  -2.737   0.097  1.00  0.00           C  
HETATM   21  C   UNL     1       0.704  -3.134  -1.069  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.577  -3.193  -0.810  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.770  -2.834   0.531  1.00  0.00           N  
HETATM   24  C   UNL     1       0.439  -2.564   1.066  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.056  -2.769   1.229  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.720  -0.209  -0.921  1.00  0.00           C  
HETATM   27  N   UNL     1       3.278   1.965   1.664  1.00  0.00           N  
HETATM   28  N   UNL     1       2.831   1.088   2.663  1.00  0.00           N  
HETATM   29  N   UNL     1       2.748  -0.102   2.181  1.00  0.00           N  
HETATM   30  O   UNL     1      -3.940   1.646   0.348  1.00  0.00           O  
HETATM   31  H   UNL     1      -3.622   4.170   0.975  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.784  -3.443  -0.732  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.319  -1.970  -1.971  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.645   5.531   0.429  1.00  0.00           H  
HETATM   35  H   UNL     1       0.236   4.533  -0.804  1.00  0.00           H  
HETATM   36  H   UNL     1       0.147   2.172  -1.492  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.822   0.801  -0.942  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.389  -0.106   1.526  1.00  0.00           H  
HETATM   39  H   UNL     1       3.719  -1.532  -2.107  1.00  0.00           H  
HETATM   40  H   UNL     1       4.460   0.207  -3.586  1.00  0.00           H  
HETATM   41  H   UNL     1       4.616   1.811  -3.108  1.00  0.00           H  
HETATM   42  H   UNL     1       3.380  -3.216  -0.429  1.00  0.00           H  
HETATM   43  H   UNL     1       3.146  -2.759   1.276  1.00  0.00           H  
HETATM   44  H   UNL     1       1.169  -3.355  -2.018  1.00  0.00           H  
HETATM   45  H   UNL     1       0.631  -2.262   2.085  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.904  -2.375   2.234  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.486  -3.768   1.292  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.394   0.437  -1.465  1.00  0.00           H  
HETATM   49  H   UNL     1       3.426   2.919   1.755  1.00  0.00           H  
CONECT    1   30   11   11   26                                       
CONECT    2    6    3    3   31                                       
CONECT    3    2    2    9   30                                       
CONECT    4   10   10    5   32                                       
CONECT    5   26   26    4   33                                       
CONECT    6    7    7    2   34                                       
CONECT    7    6    6    8   35                                       
CONECT    8    7    9    9   36                                       
CONECT    9    8    8    3   37                                       
CONECT   10   11   25    4    4                                       
CONECT   11    1    1   10   38                                       
CONECT   12   17   13   13   39                                       
CONECT   13   12   12   14   18                                       
CONECT   14   15   15   13                                            
CONECT   15   16   27   14   14                                       
CONECT   16   29   17   17   15                                       
CONECT   17   19   16   16   12                                       
CONECT   18   13   40   41                                            
CONECT   19   17   20   42   43                                       
CONECT   20   19   21   24   24                                       
CONECT   21   20   22   22   44                                       
CONECT   22   21   21   23                                            
CONECT   23   24   22   25                                            
CONECT   24   20   20   23   45                                       
CONECT   25   23   10   46   47                                       
CONECT   26    1    5    5   48                                       
CONECT   27   28   15   49                                            
CONECT   28   29   29   27                                            
CONECT   29   28   28   16                                            
CONECT   30    3    1                                                 
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
