COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.279   3.023  -0.904  1.00  0.00           O  
HETATM    2  O   UNL     1      -2.461   2.030   0.345  1.00  0.00           O  
HETATM    3  C   UNL     1       2.316   0.946  -0.130  1.00  0.00           C  
HETATM    4  C   UNL     1       3.661   0.518   0.461  1.00  0.00           C  
HETATM    5  C   UNL     1       4.762   1.580   0.444  1.00  0.00           C  
HETATM    6  C   UNL     1       4.077  -0.945   0.298  1.00  0.00           C  
HETATM    7  C   UNL     1       3.121  -1.880  -0.445  1.00  0.00           C  
HETATM    8  C   UNL     1       1.507   1.693   0.933  1.00  0.00           C  
HETATM    9  N   UNL     1      -2.660  -0.041  -0.431  1.00  0.00           N  
HETATM   10  C   UNL     1       1.075   1.527   3.284  1.00  0.00           C  
HETATM   11  O   UNL     1       1.283   0.834   2.052  1.00  0.00           O  
HETATM   12  O   UNL     1       3.645  -0.408   1.549  1.00  0.00           O  
HETATM   13  C   UNL     1       3.762  -3.235  -0.599  1.00  0.00           C  
HETATM   14  C   UNL     1       3.122  -4.311  -0.212  1.00  0.00           C  
HETATM   15  C   UNL     1       3.826  -5.643  -0.201  1.00  0.00           C  
HETATM   16  C   UNL     1       1.683  -4.215   0.224  1.00  0.00           C  
HETATM   17  C   UNL     1       2.555   1.866  -1.329  1.00  0.00           C  
HETATM   18  C   UNL     1       3.364   1.120  -2.391  1.00  0.00           C  
HETATM   19  C   UNL     1       1.211   2.295  -1.919  1.00  0.00           C  
HETATM   20  C   UNL     1       0.401   3.041  -0.857  1.00  0.00           C  
HETATM   21  C   UNL     1       0.162   2.121   0.342  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.573   0.946  -0.089  1.00  0.00           O  
HETATM   23  C   UNL     1      -1.917   1.015  -0.044  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.122   0.035  -0.382  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.718  -0.947  -1.393  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.245  -0.868  -1.342  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.727  -1.229   0.064  1.00  0.00           C  
HETATM   28  N   UNL     1      -8.194  -1.153   0.113  1.00  0.00           N  
HETATM   29  C   UNL     1      -6.132  -0.248   1.076  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.605  -0.327   1.025  1.00  0.00           C  
HETATM   31  H   UNL     1       3.467   3.652  -1.614  1.00  0.00           H  
HETATM   32  H   UNL     1       1.764   0.064  -0.454  1.00  0.00           H  
HETATM   33  H   UNL     1       5.712   1.123   0.721  1.00  0.00           H  
HETATM   34  H   UNL     1       4.841   2.005  -0.557  1.00  0.00           H  
HETATM   35  H   UNL     1       4.517   2.369   1.155  1.00  0.00           H  
HETATM   36  H   UNL     1       5.139  -1.160   0.177  1.00  0.00           H  
HETATM   37  H   UNL     1       2.196  -1.979   0.122  1.00  0.00           H  
HETATM   38  H   UNL     1       2.901  -1.468  -1.430  1.00  0.00           H  
HETATM   39  H   UNL     1       2.059   2.575   1.256  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.226  -0.851  -0.741  1.00  0.00           H  
HETATM   41  H   UNL     1       1.913   2.199   3.469  1.00  0.00           H  
HETATM   42  H   UNL     1       0.153   2.104   3.225  1.00  0.00           H  
HETATM   43  H   UNL     1       1.001   0.806   4.099  1.00  0.00           H  
HETATM   44  H   UNL     1       4.749  -3.320  -1.030  1.00  0.00           H  
HETATM   45  H   UNL     1       3.692  -6.133  -1.166  1.00  0.00           H  
HETATM   46  H   UNL     1       4.889  -5.491  -0.015  1.00  0.00           H  
HETATM   47  H   UNL     1       3.405  -6.270   0.586  1.00  0.00           H  
HETATM   48  H   UNL     1       1.319  -3.201   0.056  1.00  0.00           H  
HETATM   49  H   UNL     1       1.081  -4.917  -0.354  1.00  0.00           H  
HETATM   50  H   UNL     1       1.607  -4.458   1.283  1.00  0.00           H  
HETATM   51  H   UNL     1       4.282   0.735  -1.946  1.00  0.00           H  
HETATM   52  H   UNL     1       2.774   0.290  -2.781  1.00  0.00           H  
HETATM   53  H   UNL     1       3.613   1.802  -3.204  1.00  0.00           H  
HETATM   54  H   UNL     1       1.381   2.950  -2.773  1.00  0.00           H  
HETATM   55  H   UNL     1       0.658   1.413  -2.243  1.00  0.00           H  
HETATM   56  H   UNL     1       0.954   3.924  -0.533  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.557   3.347  -1.278  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.414   2.653   1.099  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.442   1.048  -0.626  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.374  -0.689  -2.395  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.398  -1.959  -1.149  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.565   0.145  -1.587  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.669  -1.567  -2.063  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.407  -2.242   0.309  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.537  -1.388   1.032  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.518  -0.242  -0.172  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.452   0.765   0.831  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.476  -0.506   2.078  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.285  -1.340   1.269  1.00  0.00           H  
HETATM   70  H   UNL     1      -4.181   0.372   1.745  1.00  0.00           H  
CONECT    1   17   31                                                 
CONECT    2   23   23                                                 
CONECT    3    4   17    8   32                                       
CONECT    4    6    5   12    3                                       
CONECT    5    4   33   34   35                                       
CONECT    6    7    4   12   36                                       
CONECT    7   13    6   37   38                                       
CONECT    8    3   11   21   39                                       
CONECT    9   23   24   40                                            
CONECT   10   11   41   42   43                                       
CONECT   11    8   10                                                 
CONECT   12    6    4                                                 
CONECT   13   14   14    7   44                                       
CONECT   14   15   16   13   13                                       
CONECT   15   14   45   46   47                                       
CONECT   16   14   48   49   50                                       
CONECT   17   18    1    3   19                                       
CONECT   18   17   51   52   53                                       
CONECT   19   17   20   54   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21    8   20   22   58                                       
CONECT   22   21   23                                                 
CONECT   23   22    9    2    2                                       
CONECT   24    9   30   25   59                                       
CONECT   25   24   26   60   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   29   26   28   64                                       
CONECT   28   27   65   66                                            
CONECT   29   30   27   67   68                                       
CONECT   30   24   29   69   70                                       
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   28                                                      
CONECT   66   28                                                      
CONECT   67   29                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   30                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
