COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.799  -0.549   1.576  1.00  0.00           C  
HETATM    2  C   UNL     1       1.291  -0.589   1.839  1.00  0.00           C  
HETATM    3  C   UNL     1       0.581   0.319   0.831  1.00  0.00           C  
HETATM    4  C   UNL     1       1.153   1.735   0.943  1.00  0.00           C  
HETATM    5  C   UNL     1       2.666   1.685   0.715  1.00  0.00           C  
HETATM    6  C   UNL     1       3.255   3.087   0.886  1.00  0.00           C  
HETATM    7  O   UNL     1       0.816  -1.929   1.693  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.820   0.346   1.115  1.00  0.00           O  
HETATM    9  O   UNL     1       0.549   2.575  -0.043  1.00  0.00           O  
HETATM   10  O   UNL     1       3.261   0.800   1.666  1.00  0.00           O  
HETATM   11  O   UNL     1       4.646   3.063   0.559  1.00  0.00           O  
HETATM   12  C   UNL     1       5.057  -2.179   1.081  1.00  0.00           C  
HETATM   13  C   UNL     1       4.455  -1.274   0.003  1.00  0.00           C  
HETATM   14  C   UNL     1       4.629  -1.924  -1.383  1.00  0.00           C  
HETATM   15  C   UNL     1       5.529  -0.932  -2.158  1.00  0.00           C  
HETATM   16  C   UNL     1       6.201  -0.138  -1.008  1.00  0.00           C  
HETATM   17  C   UNL     1       6.645   1.243  -1.495  1.00  0.00           C  
HETATM   18  O   UNL     1       5.055  -1.493   2.334  1.00  0.00           O  
HETATM   19  O   UNL     1       3.068  -1.059   0.269  1.00  0.00           O  
HETATM   20  O   UNL     1       3.364  -2.063  -2.033  1.00  0.00           O  
HETATM   21  O   UNL     1       6.506  -1.628  -2.935  1.00  0.00           O  
HETATM   22  O   UNL     1       5.152  -0.017  -0.024  1.00  0.00           O  
HETATM   23  O   UNL     1       7.362   1.908  -0.453  1.00  0.00           O  
HETATM   24  P   UNL     1      -1.938  -0.132   0.060  1.00  0.00           P  
HETATM   25  O   UNL     1      -1.770   0.612  -1.209  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.773  -1.710  -0.219  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.402   0.157   0.662  1.00  0.00           O  
HETATM   28  C   UNL     1      -4.605  -0.061  -0.079  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.372   1.259  -0.208  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.592   2.194  -0.955  1.00  0.00           O  
HETATM   31  C   UNL     1      -6.695   0.998  -0.935  1.00  0.00           C  
HETATM   32  O   UNL     1      -7.452   2.209  -0.998  1.00  0.00           O  
HETATM   33  C   UNL     1      -7.490  -0.063  -0.168  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.786  -0.372  -0.920  1.00  0.00           C  
HETATM   35  O   UNL     1      -9.580  -1.276  -0.148  1.00  0.00           O  
HETATM   36  O   UNL     1      -6.707  -1.253  -0.057  1.00  0.00           O  
HETATM   37  C   UNL     1      -5.479  -1.082   0.654  1.00  0.00           C  
HETATM   38  O   UNL     1      -4.793  -2.333   0.728  1.00  0.00           O  
HETATM   39  H   UNL     1       3.313  -1.160   2.318  1.00  0.00           H  
HETATM   40  H   UNL     1       1.088  -0.238   2.851  1.00  0.00           H  
HETATM   41  H   UNL     1       0.742  -0.060  -0.178  1.00  0.00           H  
HETATM   42  H   UNL     1       0.948   2.133   1.937  1.00  0.00           H  
HETATM   43  H   UNL     1       2.870   1.326  -0.293  1.00  0.00           H  
HETATM   44  H   UNL     1       2.738   3.781   0.223  1.00  0.00           H  
HETATM   45  H   UNL     1       3.130   3.411   1.919  1.00  0.00           H  
HETATM   46  H   UNL     1       1.227  -2.560   2.298  1.00  0.00           H  
HETATM   47  H   UNL     1       0.866   3.489  -0.029  1.00  0.00           H  
HETATM   48  H   UNL     1       5.085   3.920   0.645  1.00  0.00           H  
HETATM   49  H   UNL     1       4.463  -3.089   1.164  1.00  0.00           H  
HETATM   50  H   UNL     1       6.081  -2.436   0.809  1.00  0.00           H  
HETATM   51  H   UNL     1       5.120  -2.893  -1.292  1.00  0.00           H  
HETATM   52  H   UNL     1       4.931  -0.273  -2.787  1.00  0.00           H  
HETATM   53  H   UNL     1       7.048  -0.691  -0.604  1.00  0.00           H  
HETATM   54  H   UNL     1       7.290   1.132  -2.366  1.00  0.00           H  
HETATM   55  H   UNL     1       5.768   1.832  -1.765  1.00  0.00           H  
HETATM   56  H   UNL     1       5.423  -2.008   3.065  1.00  0.00           H  
HETATM   57  H   UNL     1       3.414  -2.467  -2.910  1.00  0.00           H  
HETATM   58  H   UNL     1       7.094  -1.049  -3.438  1.00  0.00           H  
HETATM   59  H   UNL     1       7.675   2.791  -0.692  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.871  -2.260   0.570  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.359  -0.438  -1.071  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.573   1.662   0.785  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.018   3.054  -1.076  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.492   0.642  -1.945  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.304   2.118  -1.446  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.727   0.310   0.828  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.341   0.552  -1.082  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.549  -0.828  -1.881  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.419  -1.516  -0.564  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.690  -0.723   1.661  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.290  -3.029   1.181  1.00  0.00           H  
CONECT    1    2   10   39   19                                       
CONECT    2    1    3    7   40                                       
CONECT    3    2    4    8   41                                       
CONECT    4    3    5    9   42                                       
CONECT    5    4    6   10   43                                       
CONECT    6    5   11   44   45                                       
CONECT    7    2   46                                                 
CONECT    8    3   24                                                 
CONECT    9    4   47                                                 
CONECT   10    1    5                                                 
CONECT   11    6   48                                                 
CONECT   12   13   18   49   50                                       
CONECT   13   12   14   19   22                                       
CONECT   14   13   15   20   51                                       
CONECT   15   14   16   21   52                                       
CONECT   16   15   17   22   53                                       
CONECT   17   16   23   54   55                                       
CONECT   18   12   56                                                 
CONECT   19   13    1                                                 
CONECT   20   14   57                                                 
CONECT   21   15   58                                                 
CONECT   22   13   16                                                 
CONECT   23   17   59                                                 
CONECT   24   27   25   25   26                                       
CONECT   24    8                                                      
CONECT   25   24   24                                                 
CONECT   26   24   60                                                 
CONECT   27   28   24                                                 
CONECT   28   37   29   27   61                                       
CONECT   29   31   28   30   62                                       
CONECT   30   29   63                                                 
CONECT   31   33   32   29   64                                       
CONECT   32   31   65                                                 
CONECT   33   34   36   31   66                                       
CONECT   34   35   33   67   68                                       
CONECT   35   34   69                                                 
CONECT   36   33   37                                                 
CONECT   37   36   38   28   70                                       
CONECT   38   37   71                                                 
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   26                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   34                                                      
CONECT   69   35                                                      
CONECT   70   37                                                      
CONECT   71   38                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
