COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.876   1.205  -0.051  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.212   0.733   0.461  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.296   0.666  -0.394  1.00  0.00           C  
HETATM    4  C   UNL     1      -8.522   0.233   0.076  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.663  -0.134   1.402  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.579  -0.068   2.257  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.352   0.361   1.785  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.891   0.322  -1.039  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.467   1.461  -1.061  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.117   0.069  -0.543  1.00  0.00           O  
HETATM   11  N   UNL     1      -2.134  -0.688  -1.512  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.800  -0.413  -2.052  1.00  0.00           C  
HETATM   13  P   UNL     1       0.447  -0.667  -0.747  1.00  0.00           P  
HETATM   14  O   UNL     1       0.174   0.249   0.382  1.00  0.00           O  
HETATM   15  O   UNL     1       0.381  -2.191  -0.230  1.00  0.00           O  
HETATM   16  N   UNL     1       1.980  -0.351  -1.367  1.00  0.00           N  
HETATM   17  C   UNL     1       3.001  -0.435  -0.315  1.00  0.00           C  
HETATM   18  C   UNL     1       4.074   0.591  -0.574  1.00  0.00           C  
HETATM   19  O   UNL     1       4.139   1.142  -1.652  1.00  0.00           O  
HETATM   20  C   UNL     1       3.621  -1.834  -0.316  1.00  0.00           C  
HETATM   21  C   UNL     1       4.582  -1.967   0.867  1.00  0.00           C  
HETATM   22  C   UNL     1       3.788  -1.924   2.175  1.00  0.00           C  
HETATM   23  C   UNL     1       5.331  -3.298   0.769  1.00  0.00           C  
HETATM   24  C   UNL     1       7.839   3.228   1.201  1.00  0.00           C  
HETATM   25  C   UNL     1       6.821   2.108   1.422  1.00  0.00           C  
HETATM   26  C   UNL     1       5.938   1.968   0.181  1.00  0.00           C  
HETATM   27  N   UNL     1       4.963   0.895   0.393  1.00  0.00           N  
HETATM   28  H   UNL     1      -5.029   1.918  -0.862  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.327   1.687   0.757  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.186   0.952  -1.429  1.00  0.00           H  
HETATM   31  H   UNL     1      -9.369   0.182  -0.591  1.00  0.00           H  
HETATM   32  H   UNL     1      -9.621  -0.472   1.769  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.690  -0.354   3.292  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.504   0.408   2.452  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.473  -1.597  -1.495  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.599  -1.088  -2.884  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.756   0.618  -2.401  1.00  0.00           H  
HETATM   38  H   UNL     1       0.624  -2.844  -0.900  1.00  0.00           H  
HETATM   39  H   UNL     1       2.196  -0.974  -2.131  1.00  0.00           H  
HETATM   40  H   UNL     1       2.541  -0.243   0.654  1.00  0.00           H  
HETATM   41  H   UNL     1       2.832  -2.581  -0.230  1.00  0.00           H  
HETATM   42  H   UNL     1       4.168  -1.988  -1.247  1.00  0.00           H  
HETATM   43  H   UNL     1       5.297  -1.145   0.849  1.00  0.00           H  
HETATM   44  H   UNL     1       4.478  -1.944   3.019  1.00  0.00           H  
HETATM   45  H   UNL     1       3.197  -1.009   2.211  1.00  0.00           H  
HETATM   46  H   UNL     1       3.125  -2.787   2.227  1.00  0.00           H  
HETATM   47  H   UNL     1       5.896  -3.329  -0.162  1.00  0.00           H  
HETATM   48  H   UNL     1       6.015  -3.392   1.612  1.00  0.00           H  
HETATM   49  H   UNL     1       4.615  -4.120   0.788  1.00  0.00           H  
HETATM   50  H   UNL     1       7.313   4.166   1.021  1.00  0.00           H  
HETATM   51  H   UNL     1       8.468   3.328   2.085  1.00  0.00           H  
HETATM   52  H   UNL     1       8.460   2.989   0.338  1.00  0.00           H  
HETATM   53  H   UNL     1       7.346   1.170   1.602  1.00  0.00           H  
HETATM   54  H   UNL     1       6.199   2.347   2.285  1.00  0.00           H  
HETATM   55  H   UNL     1       5.412   2.906   0.001  1.00  0.00           H  
HETATM   56  H   UNL     1       6.559   1.729  -0.682  1.00  0.00           H  
HETATM   57  H   UNL     1       4.957   0.404   1.229  1.00  0.00           H  
CONECT    1    2   10   28   29                                       
CONECT    2    3    1    7    7                                       
CONECT    3    4    4    2   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6    6   32                                       
CONECT    6    5    5    7   33                                       
CONECT    7    2    2    6   34                                       
CONECT    8   10    9    9   11                                       
CONECT    9    8    8                                                 
CONECT   10    1    8                                                 
CONECT   11    8   12   35                                            
CONECT   12   11   13   36   37                                       
CONECT   13   12   14   14   15                                       
CONECT   13   16                                                      
CONECT   14   13   13                                                 
CONECT   15   13   38                                                 
CONECT   16   13   17   39                                            
CONECT   17   16   18   20   40                                       
CONECT   18   27   19   19   17                                       
CONECT   19   18   18                                                 
CONECT   20   17   21   41   42                                       
CONECT   21   20   22   23   43                                       
CONECT   22   21   44   45   46                                       
CONECT   23   21   47   48   49                                       
CONECT   24   25   50   51   52                                       
CONECT   25   26   24   53   54                                       
CONECT   26   27   25   55   56                                       
CONECT   27   26   18   57                                            
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
