COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.766   0.597   2.357  1.00  0.00           O  
HETATM    2  O   UNL     1       4.167  -1.536   1.143  1.00  0.00           O  
HETATM    3  O   UNL     1       3.432  -2.318  -1.452  1.00  0.00           O  
HETATM    4  O   UNL     1       5.201  -0.501  -2.466  1.00  0.00           O  
HETATM    5  O   UNL     1       1.837  -2.766   1.385  1.00  0.00           O  
HETATM    6  O   UNL     1       1.783   2.238  -0.261  1.00  0.00           O  
HETATM    7  O   UNL     1       4.548   2.222   1.171  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.798   2.323  -0.326  1.00  0.00           O  
HETATM    9  O   UNL     1      -5.445  -1.987   0.011  1.00  0.00           O  
HETATM   10  O   UNL     1      -6.366   1.252   0.344  1.00  0.00           O  
HETATM   11  O   UNL     1      -6.019   0.775  -1.796  1.00  0.00           O  
HETATM   12  C   UNL     1       3.049  -0.932   0.491  1.00  0.00           C  
HETATM   13  C   UNL     1       2.918   0.531   0.938  1.00  0.00           C  
HETATM   14  C   UNL     1       3.257  -0.966  -1.025  1.00  0.00           C  
HETATM   15  C   UNL     1       1.785  -1.675   0.857  1.00  0.00           C  
HETATM   16  C   UNL     1       1.713   1.143   0.257  1.00  0.00           C  
HETATM   17  C   UNL     1       0.486  -1.044   0.558  1.00  0.00           C  
HETATM   18  C   UNL     1       0.459   0.385   0.239  1.00  0.00           C  
HETATM   19  C   UNL     1       4.161   1.275   0.517  1.00  0.00           C  
HETATM   20  C   UNL     1       4.482  -0.164  -1.378  1.00  0.00           C  
HETATM   21  C   UNL     1       4.871   0.881  -0.627  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.753   1.000  -0.050  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.682  -1.772   0.564  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.940   0.229  -0.052  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.908  -1.138   0.274  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.168   0.838  -0.343  1.00  0.00           C  
HETATM   27  C   UNL     1       2.516   1.913   2.854  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.100  -1.880   0.285  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.331   0.083  -0.341  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.297  -1.265  -0.001  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.226   2.311  -0.656  1.00  0.00           C  
HETATM   32  C   UNL     1       6.372   0.307  -2.757  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.624   0.724  -0.648  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.334  -3.376   0.329  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.627   1.867  -0.032  1.00  0.00           C  
HETATM   36  H   UNL     1       4.308  -2.463   0.905  1.00  0.00           H  
HETATM   37  H   UNL     1       3.570  -2.415  -2.405  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.695   2.533  -1.264  1.00  0.00           H  
HETATM   39  H   UNL     1       2.386  -0.538  -1.521  1.00  0.00           H  
HETATM   40  H   UNL     1       5.755   1.433  -0.912  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.660  -2.828   0.791  1.00  0.00           H  
HETATM   42  H   UNL     1       2.356   1.871   3.931  1.00  0.00           H  
HETATM   43  H   UNL     1       3.373   2.551   2.639  1.00  0.00           H  
HETATM   44  H   UNL     1       1.628   2.322   2.371  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.077  -2.934   0.519  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.981   2.470  -1.706  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.229   2.687  -0.456  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.508   2.844  -0.031  1.00  0.00           H  
HETATM   49  H   UNL     1       6.069   1.342  -2.915  1.00  0.00           H  
HETATM   50  H   UNL     1       7.067   0.255  -1.919  1.00  0.00           H  
HETATM   51  H   UNL     1       6.859  -0.071  -3.657  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.323  -3.835   0.304  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.688  -3.866  -0.399  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.908  -3.487   1.326  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.439   2.686  -0.725  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.265   1.124  -0.511  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.123   2.251   0.859  1.00  0.00           H  
CONECT    1   13   27                                                 
CONECT    2   12   36                                                 
CONECT    3   14   37                                                 
CONECT    4   20   32                                                 
CONECT    5   15   15                                                 
CONECT    6   16   16                                                 
CONECT    7   19   19                                                 
CONECT    8   22   38                                                 
CONECT    9   30   34                                                 
CONECT   10   33   35                                                 
CONECT   11   33   33                                                 
CONECT   12    2   13   14   15                                       
CONECT   13    1   12   16   19                                       
CONECT   14    3   12   20   39                                       
CONECT   15    5    5   12   17                                       
CONECT   16    6    6   13   18                                       
CONECT   17   15   18   23   23                                       
CONECT   18   16   17   22   22                                       
CONECT   19    7    7   13   21                                       
CONECT   20    4   14   21   21                                       
CONECT   21   19   20   20   40                                       
CONECT   22    8   18   18   24                                       
CONECT   23   17   17   25   41                                       
CONECT   24   22   25   25   26                                       
CONECT   25   23   24   24   28                                       
CONECT   26   24   29   29   31                                       
CONECT   27    1   42   43   44                                       
CONECT   28   25   30   30   45                                       
CONECT   29   26   26   30   33                                       
CONECT   30    9   28   28   29                                       
CONECT   31   26   46   47   48                                       
CONECT   32    4   49   50   51                                       
CONECT   33   10   11   11   29                                       
CONECT   34    9   52   53   54                                       
CONECT   35   10   55   56   57                                       
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    8                                                      
CONECT   39   14                                                      
CONECT   40   21                                                      
CONECT   41   23                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
CONECT   46   31                                                      
CONECT   47   31                                                      
CONECT   48   31                                                      
CONECT   49   32                                                      
CONECT   50   32                                                      
CONECT   51   32                                                      
CONECT   52   34                                                      
CONECT   53   34                                                      
CONECT   54   34                                                      
CONECT   55   35                                                      
CONECT   56   35                                                      
CONECT   57   35                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
