COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.479   1.104  -1.806  1.00  0.00           O  
HETATM    2  B   UNL     1      -1.304   1.454   1.095  1.00  0.00           B1-
HETATM    3  P   UNL     1       5.709   1.563  -0.468  1.00  0.00           P  
HETATM    4  N   UNL     1      -2.136  -5.651   0.366  1.00  0.00           N  
HETATM    5  O   UNL     1      -1.603   1.673   2.415  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.492  -4.477  -0.121  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.690  -3.432  -0.104  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.470  -3.524   0.414  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.044  -4.754   0.945  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.936  -5.839   0.904  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.572  -7.074   1.412  1.00  0.00           N  
HETATM   12  N   UNL     1       1.219  -4.576   1.401  1.00  0.00           N  
HETATM   13  C   UNL     1       1.587  -3.345   1.189  1.00  0.00           C  
HETATM   14  N   UNL     1       0.579  -2.656   0.582  1.00  0.00           N  
HETATM   15  C   UNL     1       0.611  -1.247   0.182  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.296   2.934   2.459  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.996   3.088   1.130  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.396   2.183   0.264  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.022   3.892   0.686  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.454   3.802  -0.626  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.857   2.906  -1.492  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.824   2.093  -1.047  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.321   2.930   3.594  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.622   2.866   4.885  1.00  0.00           N  
HETATM   25  O   UNL     1      -2.235   1.212  -1.898  1.00  0.00           O  
HETATM   26  O   UNL     1       6.372   0.966   0.712  1.00  0.00           O  
HETATM   27  C   UNL     1      -0.014  -0.363   1.282  1.00  0.00           C  
HETATM   28  O   UNL     1      -1.299   0.109   0.819  1.00  0.00           O  
HETATM   29  C   UNL     1      -2.729   1.174  -3.238  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.950   0.130  -4.040  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.479   0.090  -5.475  1.00  0.00           C  
HETATM   32  O   UNL     1      -1.751  -0.885  -6.224  1.00  0.00           O  
HETATM   33  O   UNL     1       5.748   3.168  -0.352  1.00  0.00           O  
HETATM   34  C   UNL     1       0.861   0.925   1.265  1.00  0.00           C  
HETATM   35  O   UNL     1      -0.055   1.938   0.795  1.00  0.00           O  
HETATM   36  C   UNL     1       1.901   0.650   0.158  1.00  0.00           C  
HETATM   37  O   UNL     1       1.975  -0.789   0.067  1.00  0.00           O  
HETATM   38  C   UNL     1       3.262   1.229   0.551  1.00  0.00           C  
HETATM   39  O   UNL     1       4.179   1.067  -0.533  1.00  0.00           O  
HETATM   40  H   UNL     1      -3.477  -4.368  -0.550  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.197  -7.815   1.377  1.00  0.00           H  
HETATM   42  H   UNL     1       0.307  -7.198   1.802  1.00  0.00           H  
HETATM   43  H   UNL     1       2.548  -2.931   1.455  1.00  0.00           H  
HETATM   44  H   UNL     1       0.082  -1.110  -0.761  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.583   3.746   2.602  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.490   4.593   1.362  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.259   4.433  -0.973  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.195   2.839  -2.516  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.918   3.841   3.549  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.974   2.062   3.491  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.963   3.624   4.977  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.279   2.862   5.652  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.062  -0.856   2.253  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.787   0.909  -3.228  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.605   2.154  -3.699  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.892   0.395  -4.050  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.074  -0.850  -3.579  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.536  -0.175  -5.465  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.355   1.070  -5.936  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.034  -0.965  -7.145  1.00  0.00           H  
HETATM   61  H   UNL     1       1.302   1.162   2.234  1.00  0.00           H  
HETATM   62  H   UNL     1       1.567   1.074  -0.789  1.00  0.00           H  
HETATM   63  H   UNL     1       3.154   2.289   0.780  1.00  0.00           H  
HETATM   64  H   UNL     1       3.640   0.705   1.429  1.00  0.00           H  
HETATM   65  H   UNL     1       7.409   1.370  -1.836  1.00  0.00           H  
HETATM   66  H   UNL     1       5.330   3.627  -1.093  1.00  0.00           H  
CONECT    1    3   65                                                 
CONECT    2    5   18   28   35                                       
CONECT    3    1   26   26   33                                       
CONECT    3   39                                                      
CONECT    4    6    6   10                                            
CONECT    5    2   16                                                 
CONECT    6    4    4    7   40                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   14                                       
CONECT    9    8   10   10   12                                       
CONECT   10    4    9    9   11                                       
CONECT   11   10   41   42                                            
CONECT   12    9   13   13                                            
CONECT   13   12   12   14   43                                       
CONECT   14    8   13   15                                            
CONECT   15   14   27   37   44                                       
CONECT   16    5   17   23   45                                       
CONECT   17   16   18   18   19                                       
CONECT   18    2   17   17   22                                       
CONECT   19   17   20   20   46                                       
CONECT   20   19   19   21   47                                       
CONECT   21   20   22   22   48                                       
CONECT   22   18   21   21   25                                       
CONECT   23   16   24   49   50                                       
CONECT   24   23   51   52                                            
CONECT   25   22   29                                                 
CONECT   26    3    3                                                 
CONECT   27   15   28   34   53                                       
CONECT   28    2   27                                                 
CONECT   29   25   30   54   55                                       
CONECT   30   29   31   56   57                                       
CONECT   31   30   32   58   59                                       
CONECT   32   31   60                                                 
CONECT   33    3   66                                                 
CONECT   34   27   35   36   61                                       
CONECT   35    2   34                                                 
CONECT   36   34   37   38   62                                       
CONECT   37   15   36                                                 
CONECT   38   36   39   63   64                                       
CONECT   39    3   38                                                 
CONECT   40    6                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   23                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   34                                                      
CONECT   62   36                                                      
CONECT   63   38                                                      
CONECT   64   38                                                      
CONECT   65    1                                                      
CONECT   66   33                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
