COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.338   3.288   0.153  1.00  0.00           C  
HETATM    2  C   UNL     1       6.783   4.160  -0.822  1.00  0.00           C  
HETATM    3  C   UNL     1       8.055   4.022  -1.345  1.00  0.00           C  
HETATM    4  C   UNL     1       8.882   3.011  -0.892  1.00  0.00           C  
HETATM    5  C   UNL     1       8.437   2.138   0.084  1.00  0.00           C  
HETATM    6  C   UNL     1       7.167   2.281   0.611  1.00  0.00           C  
HETATM    7  C   UNL     1       6.684   1.334   1.679  1.00  0.00           C  
HETATM    8  N   UNL     1       6.036   0.179   1.051  1.00  0.00           N  
HETATM    9  C   UNL     1       4.704   0.063   0.837  1.00  0.00           C  
HETATM   10  C   UNL     1       6.697  -0.940   0.589  1.00  0.00           C  
HETATM   11  C   UNL     1       6.117  -3.034  -0.482  1.00  0.00           C  
HETATM   12  C   UNL     1       5.732  -1.812   0.060  1.00  0.00           C  
HETATM   13  C   UNL     1       4.435  -1.131   0.235  1.00  0.00           C  
HETATM   14  C   UNL     1       8.038  -1.311   0.565  1.00  0.00           C  
HETATM   15  C   UNL     1       8.405  -2.524   0.025  1.00  0.00           C  
HETATM   16  C   UNL     1       7.450  -3.384  -0.498  1.00  0.00           C  
HETATM   17  C   UNL     1       3.117  -1.638  -0.164  1.00  0.00           C  
HETATM   18  O   UNL     1       3.019  -2.727  -0.695  1.00  0.00           O  
HETATM   19  O   UNL     1       2.014  -0.895   0.060  1.00  0.00           O  
HETATM   20  C   UNL     1       0.743  -1.459  -0.361  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.384  -0.479  -0.028  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.214   0.796  -0.856  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.733  -1.124  -0.356  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.864  -0.196   0.092  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.840  -0.066   1.555  1.00  0.00           N  
HETATM   26  C   UNL     1      -4.207  -0.781  -0.347  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.230  -0.907  -1.770  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.339   0.147   0.101  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.687  -0.497  -0.227  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.858  -1.773   0.602  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.798   0.467   0.101  1.00  0.00           C  
HETATM   32  O   UNL     1      -7.536   1.562   0.553  1.00  0.00           O  
HETATM   33  N   UNL     1      -9.081   0.113  -0.107  1.00  0.00           N  
HETATM   34  C   UNL     1     -10.161   1.050   0.212  1.00  0.00           C  
HETATM   35  C   UNL     1     -11.509   0.406  -0.116  1.00  0.00           C  
HETATM   36  C   UNL     1     -12.637   1.385   0.217  1.00  0.00           C  
HETATM   37  C   UNL     1     -13.985   0.741  -0.111  1.00  0.00           C  
HETATM   38  H   UNL     1       5.343   3.396   0.561  1.00  0.00           H  
HETATM   39  H   UNL     1       6.136   4.950  -1.176  1.00  0.00           H  
HETATM   40  H   UNL     1       8.403   4.703  -2.107  1.00  0.00           H  
HETATM   41  H   UNL     1       9.876   2.902  -1.301  1.00  0.00           H  
HETATM   42  H   UNL     1       9.083   1.349   0.437  1.00  0.00           H  
HETATM   43  H   UNL     1       7.531   0.995   2.274  1.00  0.00           H  
HETATM   44  H   UNL     1       5.969   1.846   2.323  1.00  0.00           H  
HETATM   45  H   UNL     1       3.965   0.805   1.104  1.00  0.00           H  
HETATM   46  H   UNL     1       8.789  -0.649   0.968  1.00  0.00           H  
HETATM   47  H   UNL     1       5.376  -3.706  -0.889  1.00  0.00           H  
HETATM   48  H   UNL     1       7.753  -4.332  -0.918  1.00  0.00           H  
HETATM   49  H   UNL     1       9.447  -2.808   0.008  1.00  0.00           H  
HETATM   50  H   UNL     1       0.763  -1.638  -1.436  1.00  0.00           H  
HETATM   51  H   UNL     1       0.573  -2.400   0.162  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.349  -0.231   1.033  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.249   0.547  -1.917  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.017   1.493  -0.619  1.00  0.00           H  
HETATM   55  H   UNL     1       0.747   1.255  -0.623  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.804  -1.291  -1.430  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.816  -2.077   0.167  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.729   0.786  -0.362  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.963  -0.964   2.000  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.989   0.378   1.865  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.116  -0.070  -2.241  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.267   0.314   1.176  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.255   1.100  -0.421  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.723  -0.746  -1.287  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.818  -2.232   0.368  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.054  -2.470   0.364  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.822  -1.524   1.662  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.290  -0.763  -0.468  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.125   1.299   1.272  1.00  0.00           H  
HETATM   70  H   UNL     1     -10.039   1.959  -0.378  1.00  0.00           H  
HETATM   71  H   UNL     1     -11.545   0.158  -1.177  1.00  0.00           H  
HETATM   72  H   UNL     1     -11.631  -0.502   0.474  1.00  0.00           H  
HETATM   73  H   UNL     1     -12.601   1.633   1.278  1.00  0.00           H  
HETATM   74  H   UNL     1     -12.515   2.293  -0.373  1.00  0.00           H  
HETATM   75  H   UNL     1     -14.021   0.493  -1.172  1.00  0.00           H  
HETATM   76  H   UNL     1     -14.107  -0.168   0.479  1.00  0.00           H  
HETATM   77  H   UNL     1     -14.788   1.438   0.126  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.342  -1.763   0.107  1.00  0.00           H  
CONECT    1   38    2    6    6                                       
CONECT    2    1   39    3    3                                       
CONECT    3    2    2   40    4                                       
CONECT    4    3   41    5    5                                       
CONECT    5    4    4   42    6                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6   43   44    8                                       
CONECT    8    7    9   10                                            
CONECT    9    8   45   13   13                                       
CONECT   10    8   12   14   14                                       
CONECT   11   47   12   12   16                                       
CONECT   12   10   11   11   13                                       
CONECT   13    9    9   12   17                                       
CONECT   14   10   10   46   15                                       
CONECT   15   14   49   16   16                                       
CONECT   16   11   15   15   48                                       
CONECT   17   13   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20                                                 
CONECT   20   19   50   51   21                                       
CONECT   21   20   52   22   23                                       
CONECT   22   21   53   54   55                                       
CONECT   23   21   56   57   24                                       
CONECT   24   23   58   25   26                                       
CONECT   25   24   59   60                                            
CONECT   26   24   78   27   28                                       
CONECT   27   26   61                                                 
CONECT   28   26   62   63   29                                       
CONECT   29   28   30   31   64                                       
CONECT   30   29   65   66   67                                       
CONECT   31   29   32   32   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   34   68                                            
CONECT   34   33   35   69   70                                       
CONECT   35   34   36   71   72                                       
CONECT   36   35   37   73   74                                       
CONECT   37   36   75   76   77                                       
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46   14                                                      
CONECT   47   11                                                      
CONECT   48   16                                                      
CONECT   49   15                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   35                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   36                                                      
CONECT   75   37                                                      
CONECT   76   37                                                      
CONECT   77   37                                                      
CONECT   78   26                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
