COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.566  -0.554   3.337  1.00  0.00           O  
HETATM    2  C   UNL     1       6.465   0.260   3.351  1.00  0.00           C  
HETATM    3  N   UNL     1       6.566   1.170   2.363  1.00  0.00           N  
HETATM    4  C   UNL     1       5.589   1.177   1.271  1.00  0.00           C  
HETATM    5  C   UNL     1       6.019   0.177   0.193  1.00  0.00           C  
HETATM    6  O   UNL     1       6.017  -1.143   0.738  1.00  0.00           O  
HETATM    7  C   UNL     1       5.519   2.578   0.654  1.00  0.00           C  
HETATM    8  O   UNL     1       6.820   2.968   0.208  1.00  0.00           O  
HETATM    9  C   UNL     1       4.556   2.556  -0.535  1.00  0.00           C  
HETATM   10  C   UNL     1       4.527   3.937  -1.194  1.00  0.00           C  
HETATM   11  O   UNL     1       4.997   1.584  -1.486  1.00  0.00           O  
HETATM   12  C   UNL     1       5.036   0.248  -0.979  1.00  0.00           C  
HETATM   13  O   UNL     1       3.733  -0.130  -0.531  1.00  0.00           O  
HETATM   14  P   UNL     1       2.649  -0.839  -1.488  1.00  0.00           P  
HETATM   15  O   UNL     1       3.239  -2.057  -2.085  1.00  0.00           O  
HETATM   16  O   UNL     1       2.220   0.180  -2.659  1.00  0.00           O  
HETATM   17  O   UNL     1       1.351  -1.239  -0.623  1.00  0.00           O  
HETATM   18  P   UNL     1       0.144  -2.283  -0.837  1.00  0.00           P  
HETATM   19  O   UNL     1      -0.278  -2.266  -2.256  1.00  0.00           O  
HETATM   20  O   UNL     1       0.637  -3.763  -0.441  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.099  -1.864   0.097  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.362  -2.532   0.059  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.312  -1.885   1.068  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.686  -0.561   0.628  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.641  -2.669   1.134  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.642  -3.560   2.251  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.715  -1.573   1.314  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.908  -0.256   1.336  1.00  0.00           C  
HETATM   29  N   UNL     1      -5.646   0.806   0.647  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.940   0.673  -0.659  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.590  -0.329  -1.254  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.033   1.921   1.339  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.713   2.899   0.703  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.148   4.135   1.449  1.00  0.00           C  
HETATM   35  C   UNL     1      -7.011   2.749  -0.673  1.00  0.00           C  
HETATM   36  N   UNL     1      -6.616   1.633  -1.317  1.00  0.00           N  
HETATM   37  O   UNL     1      -7.623   3.618  -1.267  1.00  0.00           O  
HETATM   38  H   UNL     1       7.182   0.258   4.159  1.00  0.00           H  
HETATM   39  H   UNL     1       7.285   1.821   2.375  1.00  0.00           H  
HETATM   40  H   UNL     1       4.609   0.898   1.657  1.00  0.00           H  
HETATM   41  H   UNL     1       7.021   0.426  -0.156  1.00  0.00           H  
HETATM   42  H   UNL     1       6.280  -1.829   0.109  1.00  0.00           H  
HETATM   43  H   UNL     1       5.162   3.287   1.401  1.00  0.00           H  
HETATM   44  H   UNL     1       6.850   3.847  -0.194  1.00  0.00           H  
HETATM   45  H   UNL     1       3.556   2.297  -0.188  1.00  0.00           H  
HETATM   46  H   UNL     1       5.527   4.195  -1.541  1.00  0.00           H  
HETATM   47  H   UNL     1       3.841   3.921  -2.040  1.00  0.00           H  
HETATM   48  H   UNL     1       4.191   4.678  -0.468  1.00  0.00           H  
HETATM   49  H   UNL     1       5.361  -0.430  -1.768  1.00  0.00           H  
HETATM   50  H   UNL     1       1.825   1.003  -2.339  1.00  0.00           H  
HETATM   51  H   UNL     1       0.929  -3.848   0.477  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.785  -2.452  -0.942  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.224  -3.583   0.312  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.847  -1.842   2.053  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.808  -3.218   0.207  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.454  -4.078   2.341  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.413  -1.580   0.477  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.249  -1.712   2.255  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.689   0.038   2.362  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.797   2.017   2.388  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.366   4.891   1.386  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.065   4.522   1.005  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.328   3.884   2.494  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.821   1.520  -2.259  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   38                                       
CONECT    3    4    2   39                                            
CONECT    4    7    3    5   40                                       
CONECT    5    4   12    6   41                                       
CONECT    6    5   42                                                 
CONECT    7    9    8    4   43                                       
CONECT    8    7   44                                                 
CONECT    9   10    7   11   45                                       
CONECT   10    9   46   47   48                                       
CONECT   11    9   12                                                 
CONECT   12   11   13    5   49                                       
CONECT   13   14   12                                                 
CONECT   14   17   13   15   15                                       
CONECT   14   16                                                      
CONECT   15   14   14                                                 
CONECT   16   14   50                                                 
CONECT   17   18   14                                                 
CONECT   18   19   19   20   21                                       
CONECT   18   17                                                      
CONECT   19   18   18                                                 
CONECT   20   18   51                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   52   53                                       
CONECT   23   22   24   25   54                                       
CONECT   24   23   28                                                 
CONECT   25   23   27   26   55                                       
CONECT   26   25   56                                                 
CONECT   27   28   25   57   58                                       
CONECT   28   24   29   27   59                                       
CONECT   29   32   28   30                                            
CONECT   30   29   36   31   31                                       
CONECT   31   30   30                                                 
CONECT   32   33   33   29   60                                       
CONECT   33   34   32   32   35                                       
CONECT   34   33   61   62   63                                       
CONECT   35   33   37   37   36                                       
CONECT   36   35   30   64                                            
CONECT   37   35   35                                                 
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   16                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   32                                                      
CONECT   61   34                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   36                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
