COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.309   0.831  -2.935  1.00  0.00           C  
HETATM    2  C   UNL     1       0.501   0.666  -4.294  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.223  -0.297  -4.988  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.152  -1.101  -4.296  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.327  -0.923  -2.924  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.602   0.043  -2.255  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.800   0.235  -0.773  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.902   1.270  -0.536  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.100   1.462   0.944  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.986   0.697   1.611  1.00  0.00           N  
HETATM   11  N   UNL     1      -1.515   2.544  -1.147  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.391   3.169  -0.747  1.00  0.00           C  
HETATM   13  C   UNL     1       0.006   4.480  -1.375  1.00  0.00           C  
HETATM   14  O   UNL     1       0.301   2.677   0.118  1.00  0.00           O  
HETATM   15  O   UNL     1      -1.461   2.306   1.537  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.179   0.884   3.051  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.481   0.209   3.488  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.726  -1.056   2.687  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.718  -2.157   2.959  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.328  -1.760   2.458  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.646  -0.997   3.516  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.028   0.251   3.805  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.539  -1.607   4.255  1.00  0.00           C  
HETATM   24  C   UNL     1       0.759  -1.309   3.551  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.456   0.872   4.675  1.00  0.00           O  
HETATM   26  C   UNL     1       1.235  -2.179   2.586  1.00  0.00           C  
HETATM   27  C   UNL     1       2.421  -1.909   1.935  1.00  0.00           C  
HETATM   28  C   UNL     1       3.145  -0.763   2.258  1.00  0.00           C  
HETATM   29  C   UNL     1       2.664   0.106   3.234  1.00  0.00           C  
HETATM   30  C   UNL     1       1.474  -0.170   3.875  1.00  0.00           C  
HETATM   31  C   UNL     1       4.424  -0.469   1.564  1.00  0.00           C  
HETATM   32  C   UNL     1       4.734   0.836   1.192  1.00  0.00           C  
HETATM   33  C   UNL     1       5.928   1.104   0.553  1.00  0.00           C  
HETATM   34  C   UNL     1       6.810   0.077   0.271  1.00  0.00           C  
HETATM   35  C   UNL     1       6.504  -1.222   0.633  1.00  0.00           C  
HETATM   36  C   UNL     1       5.316  -1.500   1.278  1.00  0.00           C  
HETATM   37  C   UNL     1      -0.021  -0.477  -6.442  1.00  0.00           C  
HETATM   38  O   UNL     1       0.775   0.369  -7.121  1.00  0.00           O  
HETATM   39  O   UNL     1      -0.574  -1.388  -7.023  1.00  0.00           O  
HETATM   40  C   UNL     1      -1.927  -2.125  -5.016  1.00  0.00           C  
HETATM   41  O   UNL     1      -2.777  -2.764  -4.433  1.00  0.00           O  
HETATM   42  H   UNL     1       0.874   1.580  -2.400  1.00  0.00           H  
HETATM   43  H   UNL     1       1.214   1.286  -4.818  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.037  -1.535  -2.387  1.00  0.00           H  
HETATM   45  H   UNL     1       0.129   0.586  -0.325  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.087  -0.712  -0.319  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.832   0.919  -0.984  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.497   0.022   1.137  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.069   2.937  -1.840  1.00  0.00           H  
HETATM   50  H   UNL     1       0.936   4.831  -0.927  1.00  0.00           H  
HETATM   51  H   UNL     1       0.149   4.341  -2.447  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.779   5.217  -1.207  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.224   1.949   3.279  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.312   0.898   3.334  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.417  -0.042   4.547  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.693  -0.808   1.626  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.722  -1.430   2.923  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.036  -3.067   2.450  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.672  -2.345   4.032  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.423  -1.143   1.565  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.753  -2.657   2.226  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.507  -1.197   5.265  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.686  -2.686   4.305  1.00  0.00           H  
HETATM   64  H   UNL     1       0.673  -3.067   2.337  1.00  0.00           H  
HETATM   65  H   UNL     1       2.790  -2.586   1.179  1.00  0.00           H  
HETATM   66  H   UNL     1       3.221   0.996   3.488  1.00  0.00           H  
HETATM   67  H   UNL     1       1.099   0.503   4.632  1.00  0.00           H  
HETATM   68  H   UNL     1       4.046   1.639   1.411  1.00  0.00           H  
HETATM   69  H   UNL     1       6.171   2.117   0.269  1.00  0.00           H  
HETATM   70  H   UNL     1       7.740   0.290  -0.233  1.00  0.00           H  
HETATM   71  H   UNL     1       7.197  -2.021   0.410  1.00  0.00           H  
HETATM   72  H   UNL     1       5.079  -2.515   1.561  1.00  0.00           H  
HETATM   73  H   UNL     1       0.908   0.252  -8.071  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.738  -2.308  -6.064  1.00  0.00           H  
CONECT    1    2    6    6   42                                       
CONECT    2    1    3    3   43                                       
CONECT    3    2    2    4   37                                       
CONECT    4    3    5    5   40                                       
CONECT    5    4    4    6   44                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8   45   46                                       
CONECT    8    7    9   11   47                                       
CONECT    9    8   10   15   15                                       
CONECT   10    9   16   48                                            
CONECT   11    8   12   49                                            
CONECT   12   11   13   14   14                                       
CONECT   13   12   50   51   52                                       
CONECT   14   12   12                                                 
CONECT   15    9    9                                                 
CONECT   16   10   17   22   53                                       
CONECT   17   16   18   54   55                                       
CONECT   18   17   19   56   57                                       
CONECT   19   18   20   58   59                                       
CONECT   20   19   21   60   61                                       
CONECT   21   20   22   23                                            
CONECT   22   16   21   25   25                                       
CONECT   23   21   24   62   63                                       
CONECT   24   23   26   30   30                                       
CONECT   25   22   22                                                 
CONECT   26   24   27   27   64                                       
CONECT   27   26   26   28   65                                       
CONECT   28   27   29   29   31                                       
CONECT   29   28   28   30   66                                       
CONECT   30   24   24   29   67                                       
CONECT   31   28   32   36   36                                       
CONECT   32   31   33   33   68                                       
CONECT   33   32   32   34   69                                       
CONECT   34   33   35   35   70                                       
CONECT   35   34   34   36   71                                       
CONECT   36   31   31   35   72                                       
CONECT   37    3   38   39   39                                       
CONECT   38   37   73                                                 
CONECT   39   37   37                                                 
CONECT   40    4   41   41   74                                       
CONECT   41   40   40                                                 
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    5                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   20                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   34                                                      
CONECT   71   35                                                      
CONECT   72   36                                                      
CONECT   73   38                                                      
CONECT   74   40                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
