COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.336   1.138  -0.540  1.00  0.00           C  
HETATM    2  C   UNL     1       6.727   1.875  -0.593  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.646   1.743   0.494  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.835  -0.009  -1.127  1.00  0.00           C  
HETATM    5  C   UNL     1       5.816   2.729   0.008  1.00  0.00           C  
HETATM    6  C   UNL     1       6.469   0.523  -0.664  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.456   1.201   0.942  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.645  -0.551  -0.679  1.00  0.00           C  
HETATM    9  C   UNL     1       4.642   2.242   0.545  1.00  0.00           C  
HETATM   10  C   UNL     1       5.283   0.020  -0.125  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.956   0.053   0.356  1.00  0.00           C  
HETATM   12  C   UNL     1       4.361   0.884   0.488  1.00  0.00           C  
HETATM   13  C   UNL     1       4.976  -1.420  -0.196  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.179  -0.050  -0.508  1.00  0.00           C  
HETATM   15  C   UNL     1       3.812  -1.907   0.650  1.00  0.00           C  
HETATM   16  C   UNL     1       2.267  -0.706  -0.904  1.00  0.00           C  
HETATM   17  C   UNL     1       1.518  -1.274   1.414  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.258  -1.910   0.299  1.00  0.00           C  
HETATM   19  C   UNL     1       1.181   0.370  -1.007  1.00  0.00           C  
HETATM   20  C   UNL     1       0.424  -0.204   1.336  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.658  -0.538   0.843  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.513  -0.657  -0.165  1.00  0.00           C  
HETATM   23  C   UNL     1       2.708  -0.844   0.554  1.00  0.00           C  
HETATM   24  N   UNL     1       0.095   0.035  -0.075  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.150  -0.457   0.333  1.00  0.00           N  
HETATM   26  O   UNL     1       5.619  -2.177  -0.892  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.451   0.239  -1.657  1.00  0.00           O  
HETATM   28  O   UNL     1       3.213   0.406   1.022  1.00  0.00           O  
HETATM   29  H   UNL     1      -9.268   1.560  -0.887  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.037   2.640   0.952  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.374  -0.482  -1.934  1.00  0.00           H  
HETATM   32  H   UNL     1       7.641   2.271  -1.012  1.00  0.00           H  
HETATM   33  H   UNL     1       6.028   3.787   0.058  1.00  0.00           H  
HETATM   34  H   UNL     1       7.178  -0.142  -1.132  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.917   1.674   1.749  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.255  -1.448  -1.137  1.00  0.00           H  
HETATM   37  H   UNL     1       3.940   2.918   1.012  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.397  -0.311   1.877  1.00  0.00           H  
HETATM   39  H   UNL     1       3.446  -2.859   0.264  1.00  0.00           H  
HETATM   40  H   UNL     1       4.128  -2.022   1.686  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.947  -0.617   1.268  1.00  0.00           H  
HETATM   42  H   UNL     1       1.869  -1.659  -1.255  1.00  0.00           H  
HETATM   43  H   UNL     1       3.121  -0.421  -1.518  1.00  0.00           H  
HETATM   44  H   UNL     1       1.603   1.340  -0.743  1.00  0.00           H  
HETATM   45  H   UNL     1       0.793   0.402  -2.024  1.00  0.00           H  
HETATM   46  H   UNL     1       1.840  -1.390   2.448  1.00  0.00           H  
HETATM   47  H   UNL     1       1.127  -2.222   1.045  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.465  -0.552   1.865  1.00  0.00           H  
HETATM   49  H   UNL     1       0.783   0.720   1.790  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.734  -2.586   0.974  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.934  -2.386  -0.412  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.699  -0.308  -1.181  1.00  0.00           H  
CONECT    1    3    4    4   29                                       
CONECT    2    5    6    6   32                                       
CONECT    3    1    7    7   30                                       
CONECT    4    1    1    8   31                                       
CONECT    5    2    9    9   33                                       
CONECT    6    2    2   10   34                                       
CONECT    7    3    3   11   35                                       
CONECT    8    4   11   11   36                                       
CONECT    9    5    5   12   37                                       
CONECT   10    6   12   12   13                                       
CONECT   11    7    8    8   21                                       
CONECT   12    9   10   10   28                                       
CONECT   13   10   15   26   26                                       
CONECT   14   24   25   27   27                                       
CONECT   15   13   23   39   40                                       
CONECT   16   19   23   42   43                                       
CONECT   17   20   23   46   47                                       
CONECT   18   21   22   50   51                                       
CONECT   19   16   24   44   45                                       
CONECT   20   17   24   48   49                                       
CONECT   21   11   18   22   38                                       
CONECT   22   18   21   25   52                                       
CONECT   23   15   16   17   28                                       
CONECT   24   14   19   20                                            
CONECT   25   14   22   41                                            
CONECT   26   13   13                                                 
CONECT   27   14   14                                                 
CONECT   28   12   23                                                 
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    2                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   21                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   25                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   22                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
