COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.664  -0.180  -0.856  1.00  0.00           C  
HETATM    2  N   UNL     1       3.119  -0.195  -0.602  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.189   0.306  -0.031  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.682   2.548  -0.208  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.494  -0.335   0.232  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.340   2.230  -0.318  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.970   0.882  -0.275  1.00  0.00           C  
HETATM    8  C   UNL     1       8.105   1.312   1.718  1.00  0.00           C  
HETATM    9  C   UNL     1       4.317  -0.834  -0.684  1.00  0.00           C  
HETATM   10  C   UNL     1       2.176  -1.184  -0.457  1.00  0.00           C  
HETATM   11  C   UNL     1       0.817  -0.843  -0.346  1.00  0.00           C  
HETATM   12  C   UNL     1       0.455   0.490  -0.389  1.00  0.00           C  
HETATM   13  C   UNL     1       6.262   0.125   0.518  1.00  0.00           C  
HETATM   14  C   UNL     1       7.571   0.899   0.345  1.00  0.00           C  
HETATM   15  C   UNL     1       6.540  -1.186   1.256  1.00  0.00           C  
HETATM   16  C   UNL     1       1.458   1.478  -0.542  1.00  0.00           C  
HETATM   17  C   UNL     1       2.752   1.120  -0.643  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.391   0.831   0.346  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.004   0.928   0.208  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.438  -2.650   0.468  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.569   1.575  -0.068  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.916  -0.043  -0.132  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.149  -0.681   0.124  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.531  -1.190   0.385  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.708  -0.434   0.452  1.00  0.00           N  
HETATM   26  N   UNL     1       4.087  -2.118  -0.586  1.00  0.00           N  
HETATM   27  N   UNL     1       2.826  -2.337  -0.452  1.00  0.00           N  
HETATM   28  H   UNL     1       6.327  -0.853  -1.400  1.00  0.00           H  
HETATM   29  H   UNL     1       5.549   0.748  -1.416  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.003   3.579  -0.237  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.597   3.005  -0.433  1.00  0.00           H  
HETATM   32  H   UNL     1       9.037   1.863   1.594  1.00  0.00           H  
HETATM   33  H   UNL     1       7.372   1.945   2.217  1.00  0.00           H  
HETATM   34  H   UNL     1       8.287   0.422   2.320  1.00  0.00           H  
HETATM   35  H   UNL     1       0.067  -1.611  -0.230  1.00  0.00           H  
HETATM   36  H   UNL     1       5.559   0.725   1.096  1.00  0.00           H  
HETATM   37  H   UNL     1       7.389   1.789  -0.257  1.00  0.00           H  
HETATM   38  H   UNL     1       8.304   0.266  -0.155  1.00  0.00           H  
HETATM   39  H   UNL     1       7.243  -1.787   0.679  1.00  0.00           H  
HETATM   40  H   UNL     1       6.966  -0.969   2.236  1.00  0.00           H  
HETATM   41  H   UNL     1       5.608  -1.738   1.380  1.00  0.00           H  
HETATM   42  H   UNL     1       1.185   2.522  -0.576  1.00  0.00           H  
HETATM   43  H   UNL     1       3.509   1.881  -0.763  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.084   1.660   0.365  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.437   1.841   0.103  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.317  -2.948   1.510  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.348  -3.095   0.067  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.580  -2.993  -0.110  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.885  -1.614   0.156  1.00  0.00           H  
CONECT    1   13    9   28   29                                       
CONECT    2   17    9   10                                            
CONECT    3   22   21   21   23                                       
CONECT    4   21    6    6   30                                       
CONECT    5   23   19   19   24                                       
CONECT    6    4    4    7   31                                       
CONECT    7   12   22   22    6                                       
CONECT    8   14   32   33   34                                       
CONECT    9    1   26   26    2                                       
CONECT   10   27   27   11    2                                       
CONECT   11   10   12   12   35                                       
CONECT   12   11   11   16    7                                       
CONECT   13   14   15    1   36                                       
CONECT   14    8   13   37   38                                       
CONECT   15   13   39   40   41                                       
CONECT   16   17   17   12   42                                       
CONECT   17   16   16    2   43                                       
CONECT   18   19   25   25   44                                       
CONECT   19    5    5   18   45                                       
CONECT   20   24   46   47   48                                       
CONECT   21    4    3    3                                            
CONECT   22    7    7    3                                            
CONECT   23    3    5   49                                            
CONECT   24   25   20    5                                            
CONECT   25   18   18   24                                            
CONECT   26    9    9   27                                            
CONECT   27   26   10   10                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   23                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
