COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.042  -3.698  -0.471  1.00  0.00           C  
HETATM    2  C   UNL     1       4.421   1.394  -0.553  1.00  0.00           C  
HETATM    3  C   UNL     1       4.886   2.691  -0.529  1.00  0.00           C  
HETATM    4  C   UNL     1       4.056   3.723  -0.119  1.00  0.00           C  
HETATM    5  C   UNL     1       1.111  -4.676  -0.302  1.00  0.00           C  
HETATM    6  C   UNL     1       1.712  -2.361  -0.182  1.00  0.00           C  
HETATM    7  N   UNL     1       2.610  -1.387  -0.342  1.00  0.00           N1+
HETATM    8  C   UNL     1       2.321  -0.122  -0.076  1.00  0.00           C  
HETATM    9  C   UNL     1       3.111   1.122  -0.164  1.00  0.00           C  
HETATM   10  C   UNL     1       2.759   3.468   0.269  1.00  0.00           C  
HETATM   11  C   UNL     1       2.270   2.164   0.251  1.00  0.00           C  
HETATM   12  N   UNL     1       1.038   1.630   0.579  1.00  0.00           N  
HETATM   13  C   UNL     1       1.047   0.255   0.389  1.00  0.00           C  
HETATM   14  C   UNL     1       0.071  -0.719   0.574  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.196  -0.383   1.031  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.056   0.056  -0.076  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.475   0.295   0.443  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.370   0.753  -0.710  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.733   0.982  -0.211  1.00  0.00           N1+
HETATM   20  C   UNL     1      -5.724   2.101   0.742  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.618   1.306  -1.337  1.00  0.00           C  
HETATM   22  C   UNL     1       0.407  -2.060   0.282  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.527  -3.094   0.445  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.173  -4.376   0.149  1.00  0.00           C  
HETATM   25  H   UNL     1       3.032  -3.948  -0.822  1.00  0.00           H  
HETATM   26  H   UNL     1       5.069   0.592  -0.873  1.00  0.00           H  
HETATM   27  H   UNL     1       5.901   2.904  -0.830  1.00  0.00           H  
HETATM   28  H   UNL     1       4.430   4.737  -0.104  1.00  0.00           H  
HETATM   29  H   UNL     1       1.371  -5.701  -0.521  1.00  0.00           H  
HETATM   30  H   UNL     1       3.499  -1.611  -0.660  1.00  0.00           H  
HETATM   31  H   UNL     1       2.121   4.279   0.587  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.146   0.321   1.752  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.662   0.982  -0.496  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.076  -0.713  -0.848  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.869  -0.631   0.863  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.455   1.064   1.215  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.976   1.679  -1.130  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.390  -0.016  -1.482  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.363   3.000   0.243  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.735   2.271   1.112  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.066   1.860   1.577  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.625   0.476  -2.045  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.629   1.476  -0.967  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.258   2.205  -1.837  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.523  -2.875   0.800  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.893  -5.170   0.275  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.066   0.150   0.251  1.00  0.00           H  
HETATM   48  H   UNL     1       0.277   2.142   0.896  1.00  0.00           H  
CONECT    1    6    6    5   25                                       
CONECT    2    9    3    3   26                                       
CONECT    3    4    2    2   27                                       
CONECT    4   10   10    3   28                                       
CONECT    5   24   24    1   29                                       
CONECT    6   22    7    1    1                                       
CONECT    7    8    8    6   30                                       
CONECT    8   13    9    7    7                                       
CONECT    9   11   11    8    2                                       
CONECT   10   11    4    4   31                                       
CONECT   11   10   12    9    9                                       
CONECT   12   11   13   48                                            
CONECT   13   12   14   14    8                                       
CONECT   14   15   13   13   22                                       
CONECT   15   16   14   32                                            
CONECT   16   17   15   33   34                                       
CONECT   17   18   16   35   36                                       
CONECT   18   19   17   37   38                                       
CONECT   19   21   18   20   47                                       
CONECT   20   19   39   40   41                                       
CONECT   21   19   42   43   44                                       
CONECT   22   14   23   23    6                                       
CONECT   23   22   22   24   45                                       
CONECT   24   23    5    5   46                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31   10                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   19                                                      
CONECT   48   12                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
