COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.728  -0.922   0.893  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.620  -3.788  -0.866  1.00  0.00           C  
HETATM    3  C   UNL     1       3.169  -0.509   0.826  1.00  0.00           C  
HETATM    4  C   UNL     1       4.735  -2.370   0.969  1.00  0.00           C  
HETATM    5  C   UNL     1       5.870  -3.096   1.645  1.00  0.00           C  
HETATM    6  O   UNL     1       2.080  -2.601   0.914  1.00  0.00           O  
HETATM    7  C   UNL     1       1.955  -1.401   0.786  1.00  0.00           C  
HETATM    8  N   UNL     1       0.731  -0.866   0.610  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.449  -1.733   0.571  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.685  -2.260  -0.858  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.993  -1.823  -1.263  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.284  -0.619  -0.522  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.729  -0.384  -0.468  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.706  -1.308  -0.691  1.00  0.00           C  
HETATM   15  N   UNL     1      -5.878  -0.757  -0.561  1.00  0.00           N  
HETATM   16  C   UNL     1      -5.728   0.552  -0.248  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.348   0.806  -0.179  1.00  0.00           C  
HETATM   18  N   UNL     1      -3.931   2.032   0.122  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.795   2.996   0.356  1.00  0.00           C  
HETATM   20  N   UNL     1      -6.101   2.805   0.306  1.00  0.00           N  
HETATM   21  C   UNL     1      -6.611   1.615   0.006  1.00  0.00           C  
HETATM   22  N   UNL     1      -7.981   1.425  -0.045  1.00  0.00           N  
HETATM   23  C   UNL     1      -8.395   0.339   0.854  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.698   2.669   0.268  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.406   0.286   1.584  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.724  -4.262  -2.210  1.00  0.00           O  
HETATM   27  N   UNL     1       4.272  -1.214   1.484  1.00  0.00           N  
HETATM   28  O   UNL     1       4.238  -2.827  -0.039  1.00  0.00           O  
HETATM   29  C   UNL     1       3.578  -0.140  -0.601  1.00  0.00           C  
HETATM   30  C   UNL     1       4.715   0.849  -0.559  1.00  0.00           C  
HETATM   31  C   UNL     1       6.022   0.398  -0.547  1.00  0.00           C  
HETATM   32  C   UNL     1       7.065   1.302  -0.508  1.00  0.00           C  
HETATM   33  C   UNL     1       6.801   2.664  -0.481  1.00  0.00           C  
HETATM   34  O   UNL     1       7.826   3.556  -0.443  1.00  0.00           O  
HETATM   35  C   UNL     1       7.479   4.942  -0.416  1.00  0.00           C  
HETATM   36  C   UNL     1       5.489   3.114  -0.493  1.00  0.00           C  
HETATM   37  C   UNL     1       4.449   2.205  -0.538  1.00  0.00           C  
HETATM   38  H   UNL     1      -2.434  -1.521   1.468  1.00  0.00           H  
HETATM   39  H   UNL     1       0.327  -4.114  -0.437  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.443  -4.190  -0.275  1.00  0.00           H  
HETATM   41  H   UNL     1       2.935   0.399   1.383  1.00  0.00           H  
HETATM   42  H   UNL     1       6.183  -2.538   2.528  1.00  0.00           H  
HETATM   43  H   UNL     1       5.539  -4.091   1.943  1.00  0.00           H  
HETATM   44  H   UNL     1       6.708  -3.183   0.954  1.00  0.00           H  
HETATM   45  H   UNL     1       0.631   0.094   0.508  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.336  -2.561   1.271  1.00  0.00           H  
HETATM   47  H   UNL     1       0.068  -1.852  -1.532  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.771   0.236  -0.961  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.533  -2.345  -0.939  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.423   3.980   0.599  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.114   0.587   1.878  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.476   0.211   0.795  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.902  -0.586   0.556  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.425   3.437  -0.456  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.772   2.491   0.222  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.427   3.001   1.270  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.169   0.850   1.768  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.690  -5.225  -2.291  1.00  0.00           H  
HETATM   59  H   UNL     1       4.670  -0.848   2.289  1.00  0.00           H  
HETATM   60  H   UNL     1       3.897  -1.038  -1.131  1.00  0.00           H  
HETATM   61  H   UNL     1       2.729   0.305  -1.120  1.00  0.00           H  
HETATM   62  H   UNL     1       6.227  -0.662  -0.569  1.00  0.00           H  
HETATM   63  H   UNL     1       8.086   0.950  -0.498  1.00  0.00           H  
HETATM   64  H   UNL     1       6.877   5.149   0.469  1.00  0.00           H  
HETATM   65  H   UNL     1       8.387   5.543  -0.387  1.00  0.00           H  
HETATM   66  H   UNL     1       6.907   5.190  -1.310  1.00  0.00           H  
HETATM   67  H   UNL     1       5.280   4.173  -0.472  1.00  0.00           H  
HETATM   68  H   UNL     1       3.427   2.555  -0.552  1.00  0.00           H  
CONECT    1   25    9   12   38                                       
CONECT    2   10   26   39   40                                       
CONECT    3   27   29    7   41                                       
CONECT    4    5   28   28   27                                       
CONECT    5    4   42   43   44                                       
CONECT    6    7    7                                                 
CONECT    7    3    6    6    8                                       
CONECT    8    7    9   45                                            
CONECT    9    8   10    1   46                                       
CONECT   10    9   11    2   47                                       
CONECT   11   10   12                                                 
CONECT   12    1   11   13   48                                       
CONECT   13   12   17   14                                            
CONECT   14   13   15   15   49                                       
CONECT   15   16   14   14                                            
CONECT   16   17   17   21   15                                       
CONECT   17   18   13   16   16                                       
CONECT   18   19   19   17                                            
CONECT   19   18   18   20   50                                       
CONECT   20   19   21   21                                            
CONECT   21   20   20   16   22                                       
CONECT   22   21   23   24                                            
CONECT   23   22   51   52   53                                       
CONECT   24   22   54   55   56                                       
CONECT   25    1   57                                                 
CONECT   26    2   58                                                 
CONECT   27    4    3   59                                            
CONECT   28    4    4                                                 
CONECT   29    3   30   60   61                                       
CONECT   30   29   37   37   31                                       
CONECT   31   30   32   32   62                                       
CONECT   32   31   31   33   63                                       
CONECT   33   36   36   32   34                                       
CONECT   34   33   35                                                 
CONECT   35   34   64   65   66                                       
CONECT   36   37   33   33   67                                       
CONECT   37   30   30   36   68                                       
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   14                                                      
CONECT   50   19                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
CONECT   67   36                                                      
CONECT   68   37                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
