COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.540  -2.001   0.449  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.268  -0.477  -1.094  1.00  0.00           C  
HETATM    3  C   UNL     1       0.849  -1.734   0.890  1.00  0.00           C  
HETATM    4  C   UNL     1       3.269   1.864   0.581  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.910   1.662  -1.109  1.00  0.00           C  
HETATM    6  C   UNL     1       4.207  -2.350   0.253  1.00  0.00           C  
HETATM    7  C   UNL     1       2.419   0.027   2.698  1.00  0.00           C  
HETATM    8  C   UNL     1       5.206  -1.339  -0.320  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.233   1.016  -1.603  1.00  0.00           C  
HETATM   10  C   UNL     1       3.665  -1.833   1.587  1.00  0.00           C  
HETATM   11  C   UNL     1       4.508   0.004  -0.537  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.354  -0.003   1.284  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.537  -0.599  -0.164  1.00  0.00           C  
HETATM   14  C   UNL     1       1.109   0.678   0.169  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.025   0.447  -0.811  1.00  0.00           C  
HETATM   16  C   UNL     1       1.814  -0.671   0.377  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.032  -0.513  -0.122  1.00  0.00           C  
HETATM   18  C   UNL     1       2.966  -0.490   1.366  1.00  0.00           C  
HETATM   19  C   UNL     1       3.967   0.520   0.799  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.272  -0.412  -1.004  1.00  0.00           C  
HETATM   21  C   UNL     1       2.110   1.684  -0.402  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.372  -1.876  -0.034  1.00  0.00           C  
HETATM   23  C   UNL     1       4.269   2.871   0.011  1.00  0.00           C  
HETATM   24  C   UNL     1       3.606   4.247  -0.090  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.033  -0.480  -0.191  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.071   0.724   0.716  1.00  0.00           C  
HETATM   27  O   UNL     1       2.613   1.199  -1.649  1.00  0.00           O  
HETATM   28  O   UNL     1       0.048  -2.297  -1.334  1.00  0.00           O  
HETATM   29  O   UNL     1       5.708  -1.821  -1.569  1.00  0.00           O  
HETATM   30  O   UNL     1      -7.095   0.890   1.567  1.00  0.00           O  
HETATM   31  O   UNL     1      -5.179   1.538   0.676  1.00  0.00           O  
HETATM   32  C   UNL     1      -4.770  -0.429  -1.054  1.00  0.00           C  
HETATM   33  H   UNL     1      -3.532  -2.745  -0.348  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.655  -2.127   1.072  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.435  -2.130   1.058  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.278  -1.384  -1.699  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.167  -0.440  -0.479  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.239   0.395  -1.747  1.00  0.00           H  
HETATM   39  H   UNL     1       1.368  -2.691   0.944  1.00  0.00           H  
HETATM   40  H   UNL     1       0.509  -1.456   1.888  1.00  0.00           H  
HETATM   41  H   UNL     1       2.884   2.231   1.532  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.468   2.280  -1.890  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.078   2.248  -0.205  1.00  0.00           H  
HETATM   44  H   UNL     1       3.381  -2.481  -0.446  1.00  0.00           H  
HETATM   45  H   UNL     1       4.707  -3.306   0.408  1.00  0.00           H  
HETATM   46  H   UNL     1       1.705  -0.692   3.101  1.00  0.00           H  
HETATM   47  H   UNL     1       3.241   0.156   3.403  1.00  0.00           H  
HETATM   48  H   UNL     1       1.922   0.984   2.540  1.00  0.00           H  
HETATM   49  H   UNL     1       6.033  -1.210   0.378  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.087   1.594  -1.250  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.239   0.965  -2.692  1.00  0.00           H  
HETATM   52  H   UNL     1       2.952  -2.551   1.992  1.00  0.00           H  
HETATM   53  H   UNL     1       4.489  -1.703   2.289  1.00  0.00           H  
HETATM   54  H   UNL     1       5.220   0.723  -0.944  1.00  0.00           H  
HETATM   55  H   UNL     1       3.681  -0.124  -1.236  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.437   0.047   1.871  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.798   0.990   1.217  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.056  -0.684   1.765  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.558   0.145   0.632  1.00  0.00           H  
HETATM   60  H   UNL     1       0.724   1.043   1.121  1.00  0.00           H  
HETATM   61  H   UNL     1       0.356   0.019  -1.738  1.00  0.00           H  
HETATM   62  H   UNL     1       2.230  -1.002  -0.575  1.00  0.00           H  
HETATM   63  H   UNL     1       4.791   0.648   1.500  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.234  -1.157  -1.799  1.00  0.00           H  
HETATM   65  H   UNL     1       1.614   2.642  -0.558  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.072  -2.600   0.383  1.00  0.00           H  
HETATM   67  H   UNL     1       5.136   2.934   0.668  1.00  0.00           H  
HETATM   68  H   UNL     1       4.587   2.547  -0.980  1.00  0.00           H  
HETATM   69  H   UNL     1       4.319   4.964  -0.496  1.00  0.00           H  
HETATM   70  H   UNL     1       2.739   4.184  -0.747  1.00  0.00           H  
HETATM   71  H   UNL     1       3.288   4.570   0.901  1.00  0.00           H  
HETATM   72  H   UNL     1      -6.025  -1.388   0.411  1.00  0.00           H  
HETATM   73  H   UNL     1       3.255   1.788  -2.069  1.00  0.00           H  
HETATM   74  H   UNL     1       0.478  -3.163  -1.346  1.00  0.00           H  
HETATM   75  H   UNL     1       6.166  -2.671  -1.507  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.075   1.678   2.129  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.719   0.532  -1.566  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.801  -1.232  -1.790  1.00  0.00           H  
CONECT    1   13   33   34   35                                       
CONECT    2   25   36   37   38                                       
CONECT    3   22   16   39   40                                       
CONECT    4   21   19   23   41                                       
CONECT    5    9   15   42   43                                       
CONECT    6   10    8   44   45                                       
CONECT    7   18   46   47   48                                       
CONECT    8    6   11   29   49                                       
CONECT    9   20    5   50   51                                       
CONECT   10   18    6   52   53                                       
CONECT   11   19    8   54   55                                       
CONECT   12   17   56   57   58                                       
CONECT   13   32    1   20   59                                       
CONECT   14   15   16   21   60                                       
CONECT   15   17    5   14   61                                       
CONECT   16    3   14   18   62                                       
CONECT   17   12   20   22   15                                       
CONECT   18    7   16   10   19                                       
CONECT   19   18    4   11   63                                       
CONECT   20   13    9   17   64                                       
CONECT   21   14    4   27   65                                       
CONECT   22   17    3   28   66                                       
CONECT   23    4   24   67   68                                       
CONECT   24   23   69   70   71                                       
CONECT   25   26    2   32   72                                       
CONECT   26   31   31   30   25                                       
CONECT   27   21   73                                                 
CONECT   28   22   74                                                 
CONECT   29    8   75                                                 
CONECT   30   26   76                                                 
CONECT   31   26   26                                                 
CONECT   32   25   13   77   78                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   10                                                      
CONECT   54   11                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   12                                                      
CONECT   58   12                                                      
CONECT   59   13                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   16                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   21                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   23                                                      
CONECT   69   24                                                      
CONECT   70   24                                                      
CONECT   71   24                                                      
CONECT   72   25                                                      
CONECT   73   27                                                      
CONECT   74   28                                                      
CONECT   75   29                                                      
CONECT   76   30                                                      
CONECT   77   32                                                      
CONECT   78   32                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
