COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.957   2.761  -5.048  1.00  0.00           C  
HETATM    2  O   UNL     1       6.982   1.513  -5.737  1.00  0.00           O  
HETATM    3  P   UNL     1       6.790   0.139  -4.913  1.00  0.00           P  
HETATM    4  O   UNL     1       6.835  -1.107  -5.748  1.00  0.00           O  
HETATM    5  O   UNL     1       7.903   0.198  -3.740  1.00  0.00           O  
HETATM    6  O   UNL     1       5.396   0.374  -4.128  1.00  0.00           O  
HETATM    7  P   UNL     1       4.636  -0.528  -3.023  1.00  0.00           P  
HETATM    8  O   UNL     1       5.422  -0.774  -1.769  1.00  0.00           O  
HETATM    9  O   UNL     1       4.237  -1.859  -3.852  1.00  0.00           O  
HETATM   10  O   UNL     1       3.228   0.245  -2.828  1.00  0.00           O  
HETATM   11  C   UNL     1       3.242   1.544  -2.262  1.00  0.00           C  
HETATM   12  C   UNL     1       1.814   2.065  -2.179  1.00  0.00           C  
HETATM   13  O   UNL     1       1.855   3.410  -1.654  1.00  0.00           O  
HETATM   14  C   UNL     1       1.528   4.335  -2.703  1.00  0.00           C  
HETATM   15  C   UNL     1       1.551   3.545  -4.000  1.00  0.00           C  
HETATM   16  C   UNL     1       1.130   2.167  -3.536  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.280   2.126  -3.322  1.00  0.00           O  
HETATM   18  O   UNL     1       0.676   4.073  -4.975  1.00  0.00           O  
HETATM   19  N   UNL     1       2.484   5.405  -2.696  1.00  0.00           N  
HETATM   20  C   UNL     1       2.120   6.719  -3.075  1.00  0.00           C  
HETATM   21  O   UNL     1       0.984   7.039  -3.432  1.00  0.00           O  
HETATM   22  N   UNL     1       3.155   7.663  -3.021  1.00  0.00           N  
HETATM   23  C   UNL     1       4.468   7.434  -2.640  1.00  0.00           C  
HETATM   24  O   UNL     1       5.342   8.295  -2.609  1.00  0.00           O  
HETATM   25  C   UNL     1       4.765   6.038  -2.260  1.00  0.00           C  
HETATM   26  C   UNL     1       3.789   5.128  -2.306  1.00  0.00           C  
HETATM   27  C   UNL     1       5.815   3.655  -5.517  1.00  0.00           C  
HETATM   28  F   UNL     1       4.661   2.935  -5.523  1.00  0.00           F  
HETATM   29  C   UNL     1       6.057   4.219  -6.911  1.00  0.00           C  
HETATM   30  O   UNL     1       5.072   5.224  -7.152  1.00  0.00           O  
HETATM   31  C   UNL     1       7.452   4.842  -6.999  1.00  0.00           C  
HETATM   32  O   UNL     1       7.751   5.150  -8.358  1.00  0.00           O  
HETATM   33  C   UNL     1       8.522   3.884  -6.460  1.00  0.00           C  
HETATM   34  C   UNL     1       9.894   4.550  -6.405  1.00  0.00           C  
HETATM   35  O   UNL     1      10.827   3.617  -5.891  1.00  0.00           O  
HETATM   36  O   UNL     1       8.204   3.453  -5.133  1.00  0.00           O  
HETATM   37  H   UNL     1       6.797   2.514  -3.994  1.00  0.00           H  
HETATM   38  H   UNL     1       3.689   1.489  -1.265  1.00  0.00           H  
HETATM   39  H   UNL     1       3.853   2.197  -2.893  1.00  0.00           H  
HETATM   40  H   UNL     1       1.244   1.450  -1.474  1.00  0.00           H  
HETATM   41  H   UNL     1       0.546   4.774  -2.496  1.00  0.00           H  
HETATM   42  H   UNL     1       2.563   3.508  -4.422  1.00  0.00           H  
HETATM   43  H   UNL     1       1.386   1.365  -4.234  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.683   2.615  -4.055  1.00  0.00           H  
HETATM   45  H   UNL     1       1.227   4.445  -5.686  1.00  0.00           H  
HETATM   46  H   UNL     1       2.917   8.614  -3.289  1.00  0.00           H  
HETATM   47  H   UNL     1       5.771   5.785  -1.951  1.00  0.00           H  
HETATM   48  H   UNL     1       3.986   4.097  -2.031  1.00  0.00           H  
HETATM   49  H   UNL     1       5.677   4.483  -4.811  1.00  0.00           H  
HETATM   50  H   UNL     1       5.916   3.448  -7.677  1.00  0.00           H  
HETATM   51  H   UNL     1       4.742   5.498  -6.283  1.00  0.00           H  
HETATM   52  H   UNL     1       7.466   5.785  -6.439  1.00  0.00           H  
HETATM   53  H   UNL     1       7.869   4.302  -8.814  1.00  0.00           H  
HETATM   54  H   UNL     1       8.615   3.008  -7.114  1.00  0.00           H  
HETATM   55  H   UNL     1       9.858   5.421  -5.751  1.00  0.00           H  
HETATM   56  H   UNL     1      10.201   4.853  -7.406  1.00  0.00           H  
HETATM   57  H   UNL     1      10.720   3.610  -4.924  1.00  0.00           H  
HETATM   58  H   UNL     1       3.836  -2.615  -3.373  1.00  0.00           H  
HETATM   59  H   UNL     1       8.039  -0.592  -3.176  1.00  0.00           H  
CONECT    1    2   27   36   37                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    5                                       
CONECT    3    6                                                      
CONECT    4    3    3                                                 
CONECT    5    3   59                                                 
CONECT    6    3    7                                                 
CONECT    7    6    8    8    9                                       
CONECT    7   10                                                      
CONECT    8    7    7                                                 
CONECT    9    7   58                                                 
CONECT   10    7   11                                                 
CONECT   11   10   12   38   39                                       
CONECT   12   11   13   16   40                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   19   41                                       
CONECT   15   14   16   18   42                                       
CONECT   16   12   15   17   43                                       
CONECT   17   16   44                                                 
CONECT   18   15   45                                                 
CONECT   19   14   20   26                                            
CONECT   20   19   21   21   22                                       
CONECT   21   20   20                                                 
CONECT   22   20   23   46                                            
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   26   47                                       
CONECT   26   19   25   25   48                                       
CONECT   27    1   28   29   49                                       
CONECT   28   27                                                      
CONECT   29   27   30   31   50                                       
CONECT   30   29   51                                                 
CONECT   31   29   32   33   52                                       
CONECT   32   31   53                                                 
CONECT   33   31   34   36   54                                       
CONECT   34   33   35   55   56                                       
CONECT   35   34   57                                                 
CONECT   36    1   33                                                 
CONECT   37    1                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   22                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
CONECT   57   35                                                      
CONECT   58    9                                                      
CONECT   59    5                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
