COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.579  -0.405  -0.127  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.340  -1.079   0.825  1.00  0.00           C  
HETATM    3  C   UNL     1      -9.299  -0.750  -0.512  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.192   0.095  -1.274  1.00  0.00           C  
HETATM    5  C   UNL     1       1.607   0.996   0.423  1.00  0.00           C  
HETATM    6  C   UNL     1       2.896   1.599   0.039  1.00  0.00           C  
HETATM    7  C   UNL     1       3.949   0.959  -0.614  1.00  0.00           C  
HETATM    8  C   UNL     1       4.972   1.908  -0.778  1.00  0.00           C  
HETATM    9  C   UNL     1       3.983  -0.451  -1.051  1.00  0.00           C  
HETATM   10  C   UNL     1       5.075  -2.648  -1.117  1.00  0.00           C  
HETATM   11  C   UNL     1       5.489  -3.443   0.127  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.828   0.053   1.232  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.971  -0.414   1.656  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.835   0.902  -0.722  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.720   0.706   0.067  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.068   0.402  -0.269  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.107  -0.258   0.933  1.00  0.00           N  
HETATM   18  N   UNL     1      -4.440  -0.640   1.128  1.00  0.00           N  
HETATM   19  C   UNL     1      -5.122  -0.214   0.081  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.298   0.413  -0.761  1.00  0.00           N  
HETATM   21  C   UNL     1      -8.695  -1.248   0.629  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.548  -0.079  -1.461  1.00  0.00           C  
HETATM   23  N   UNL     1       0.517   1.187  -0.347  1.00  0.00           N  
HETATM   24  O   UNL     1       1.526   0.325   1.434  1.00  0.00           O  
HETATM   25  N   UNL     1       4.574   3.042  -0.264  1.00  0.00           N  
HETATM   26  N   UNL     1       3.281   2.885   0.249  1.00  0.00           N  
HETATM   27  O   UNL     1       3.044  -0.920  -1.664  1.00  0.00           O  
HETATM   28  N   UNL     1       5.054  -1.219  -0.769  1.00  0.00           N  
HETATM   29  O   UNL     1       6.703  -2.899   0.650  1.00  0.00           O  
HETATM   30  C   UNL     1       6.596  -1.543   1.090  1.00  0.00           C  
HETATM   31  C   UNL     1       6.238  -0.652  -0.104  1.00  0.00           C  
HETATM   32  C   UNL     1       2.483   3.925   0.902  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.869  -1.469   1.716  1.00  0.00           H  
HETATM   34  H   UNL     1     -10.360  -0.885  -0.662  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.607   0.619  -2.016  1.00  0.00           H  
HETATM   36  H   UNL     1       5.928   1.730  -1.250  1.00  0.00           H  
HETATM   37  H   UNL     1       5.793  -2.821  -1.918  1.00  0.00           H  
HETATM   38  H   UNL     1       4.082  -2.963  -1.439  1.00  0.00           H  
HETATM   39  H   UNL     1       4.705  -3.374   0.881  1.00  0.00           H  
HETATM   40  H   UNL     1       5.644  -4.487  -0.143  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.012  -0.934   2.601  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.763   1.428  -1.663  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.286  -1.771   1.367  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.024   0.307  -2.350  1.00  0.00           H  
HETATM   45  H   UNL     1       0.596   1.660  -1.190  1.00  0.00           H  
HETATM   46  H   UNL     1       5.815  -1.467   1.848  1.00  0.00           H  
HETATM   47  H   UNL     1       7.547  -1.221   1.513  1.00  0.00           H  
HETATM   48  H   UNL     1       7.073  -0.623  -0.804  1.00  0.00           H  
HETATM   49  H   UNL     1       6.016   0.357   0.244  1.00  0.00           H  
HETATM   50  H   UNL     1       2.744   3.974   1.959  1.00  0.00           H  
HETATM   51  H   UNL     1       2.687   4.888   0.433  1.00  0.00           H  
HETATM   52  H   UNL     1       1.424   3.689   0.799  1.00  0.00           H  
CONECT    1   19    2    2    4                                       
CONECT    2    1    1   21   33                                       
CONECT    3   21   21   22   34                                       
CONECT    4    1   22   22   35                                       
CONECT    5   23    6   24   24                                       
CONECT    6    5    7    7   26                                       
CONECT    7    6    6    8    9                                       
CONECT    8    7   25   25   36                                       
CONECT    9    7   27   27   28                                       
CONECT   10   28   11   37   38                                       
CONECT   11   10   29   39   40                                       
CONECT   12   13   13   15                                            
CONECT   13   12   12   17   41                                       
CONECT   14   15   15   16   42                                       
CONECT   15   12   14   14   23                                       
CONECT   16   14   17   20   20                                       
CONECT   17   13   16   18                                            
CONECT   18   17   19   19                                            
CONECT   19   18   18   20    1                                       
CONECT   20   16   16   19                                            
CONECT   21    2    3    3   43                                       
CONECT   22    3    4    4   44                                       
CONECT   23   15    5   45                                            
CONECT   24    5    5                                                 
CONECT   25    8    8   26                                            
CONECT   26    6   25   32                                            
CONECT   27    9    9                                                 
CONECT   28    9   10   31                                            
CONECT   29   11   30                                                 
CONECT   30   29   31   46   47                                       
CONECT   31   28   30   48   49                                       
CONECT   32   26   50   51   52                                       
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
CONECT   48   31                                                      
CONECT   49   31                                                      
CONECT   50   32                                                      
CONECT   51   32                                                      
CONECT   52   32                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
