COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.399   2.035  -1.431  1.00  0.00           O  
HETATM    2  P   UNL     1      -5.123   1.135  -0.309  1.00  0.00           P  
HETATM    3  O   UNL     1      -6.451   1.884   0.206  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.490  -0.176  -0.890  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.119   0.911   0.929  1.00  0.00           O  
HETATM    6  B   UNL     1      -2.909   0.254   0.581  1.00  0.00           B  
HETATM    7  O   UNL     1      -2.677  -0.141  -0.763  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.828  -0.036   1.682  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.682  -0.717   1.074  1.00  0.00           N  
HETATM   10  C   UNL     1       0.387  -0.005   0.668  1.00  0.00           C  
HETATM   11  O   UNL     1       0.363   1.209   0.718  1.00  0.00           O  
HETATM   12  C   UNL     1       1.593  -0.702   0.161  1.00  0.00           C  
HETATM   13  N   UNL     1       2.664  -0.021  -0.132  1.00  0.00           N  
HETATM   14  O   UNL     1       2.716   1.369   0.137  1.00  0.00           O  
HETATM   15  C   UNL     1       3.949   1.987  -0.235  1.00  0.00           C  
HETATM   16  C   UNL     1       3.893   3.457   0.095  1.00  0.00           C  
HETATM   17  O   UNL     1       4.948   4.244  -0.169  1.00  0.00           O  
HETATM   18  O   UNL     1       2.899   3.926   0.598  1.00  0.00           O  
HETATM   19  C   UNL     1       5.099   1.335   0.535  1.00  0.00           C  
HETATM   20  C   UNL     1       4.175   1.811  -1.738  1.00  0.00           C  
HETATM   21  C   UNL     1       1.580  -2.170  -0.013  1.00  0.00           C  
HETATM   22  N   UNL     1       0.547  -2.925   0.363  1.00  0.00           N  
HETATM   23  C   UNL     1       0.647  -4.201   0.156  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.318  -5.140   0.476  1.00  0.00           N  
HETATM   25  S   UNL     1       2.199  -4.554  -0.596  1.00  0.00           S  
HETATM   26  C   UNL     1       2.609  -2.841  -0.567  1.00  0.00           C  
HETATM   27  H   UNL     1      -4.130   2.911  -1.119  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.102   2.052  -0.489  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.827  -0.580  -0.903  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.499   0.904   2.125  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.259  -0.671   2.456  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.694  -1.681   0.963  1.00  0.00           H  
HETATM   33  H   UNL     1       4.865   5.180   0.061  1.00  0.00           H  
HETATM   34  H   UNL     1       5.140   0.272   0.296  1.00  0.00           H  
HETATM   35  H   UNL     1       6.040   1.807   0.251  1.00  0.00           H  
HETATM   36  H   UNL     1       4.938   1.461   1.605  1.00  0.00           H  
HETATM   37  H   UNL     1       3.356   2.275  -2.286  1.00  0.00           H  
HETATM   38  H   UNL     1       5.116   2.283  -2.021  1.00  0.00           H  
HETATM   39  H   UNL     1       4.216   0.748  -1.976  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.150  -4.860   0.890  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.163  -6.079   0.287  1.00  0.00           H  
HETATM   42  H   UNL     1       3.525  -2.403  -0.934  1.00  0.00           H  
CONECT    1    2   27                                                 
CONECT    2    5    4    4    1                                       
CONECT    2    3                                                      
CONECT    3    2   28                                                 
CONECT    4    2    2                                                 
CONECT    5    6    2                                                 
CONECT    6    8    7    5                                            
CONECT    7    6   29                                                 
CONECT    8    9    6   30   31                                       
CONECT    9   10    8   32                                            
CONECT   10   11   11   12    9                                       
CONECT   11   10   10                                                 
CONECT   12   21   10   13   13                                       
CONECT   13   12   12   14                                            
CONECT   14   13   15                                                 
CONECT   15   14   20   16   19                                       
CONECT   16   18   18   15   17                                       
CONECT   17   16   33                                                 
CONECT   18   16   16                                                 
CONECT   19   15   34   35   36                                       
CONECT   20   15   37   38   39                                       
CONECT   21   22   26   26   12                                       
CONECT   22   23   23   21                                            
CONECT   23   24   22   22   25                                       
CONECT   24   23   40   41                                            
CONECT   25   23   26                                                 
CONECT   26   25   21   21   42                                       
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   17                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
