COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1     -11.307   5.403   6.622  1.00  0.00           N  
HETATM    2  C   UNL     1     -12.066   4.339   6.946  1.00  0.00           C  
HETATM    3  C   UNL     1     -13.031   4.526   8.067  1.00  0.00           C  
HETATM    4  N   UNL     1     -12.045   3.123   6.367  1.00  0.00           N  
HETATM    5  C   UNL     1     -11.160   2.989   5.357  1.00  0.00           C  
HETATM    6  N   UNL     1     -11.084   1.735   4.702  1.00  0.00           N  
HETATM    7  C   UNL     1     -10.336   4.003   4.941  1.00  0.00           C  
HETATM    8  C   UNL     1     -10.444   5.198   5.605  1.00  0.00           C  
HETATM    9  C   UNL     1      -9.352   3.848   3.817  1.00  0.00           C  
HETATM   10  N   UNL     1      -8.074   3.396   4.282  1.00  0.00           N  
HETATM   11  S   UNL     1      -6.331   1.844   6.210  1.00  0.00           S  
HETATM   12  C   UNL     1      -6.722   1.414   4.547  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.549   2.212   3.824  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.971   1.884   2.410  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.124   0.113   4.038  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.966  -1.110   4.395  1.00  0.00           C  
HETATM   17  O   UNL     1      -8.253  -1.036   3.798  1.00  0.00           O  
HETATM   18  P   UNL     1      -9.318  -2.248   4.053  1.00  0.00           P  
HETATM   19  O   UNL     1     -10.595  -1.919   3.311  1.00  0.00           O1-
HETATM   20  O   UNL     1      -8.627  -3.579   3.845  1.00  0.00           O  
HETATM   21  O   UNL     1      -9.584  -2.047   5.653  1.00  0.00           O  
HETATM   22  P   UNL     1     -10.541  -2.874   6.686  1.00  0.00           P  
HETATM   23  O   UNL     1     -10.216  -2.032   8.047  1.00  0.00           O  
HETATM   24  O   UNL     1     -11.987  -2.639   6.312  1.00  0.00           O1-
HETATM   25  O   UNL     1      -9.999  -4.276   6.850  1.00  0.00           O  
HETATM   26  H   UNL     1     -10.650  -1.162   8.173  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.083  -1.233   5.477  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.483  -2.012   4.007  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.987   0.163   2.949  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.113  -0.015   4.443  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.374   0.927   6.375  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.526   3.896   4.934  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.718   3.126   3.080  1.00  0.00           H  
HETATM   34  H   UNL     1      -9.200   4.798   3.294  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.834   6.058   5.346  1.00  0.00           H  
HETATM   36  H   UNL     1     -11.733   1.021   4.951  1.00  0.00           H  
HETATM   37  H   UNL     1     -10.326   1.565   4.076  1.00  0.00           H  
HETATM   38  H   UNL     1     -13.764   3.710   8.080  1.00  0.00           H  
HETATM   39  H   UNL     1     -12.517   4.548   9.037  1.00  0.00           H  
HETATM   40  H   UNL     1     -13.571   5.477   7.973  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.890   2.772   1.773  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.360   1.113   1.935  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.014   1.550   2.398  1.00  0.00           H  
CONECT    1    8    2    2                                            
CONECT    2    1    1    4    3                                       
CONECT    3    2   38   39   40                                       
CONECT    4    2    5    5                                            
CONECT    5    4    4    7    6                                       
CONECT    6    5   36   37                                            
CONECT    7    5    9    8    8                                       
CONECT    8    1    7    7   35                                       
CONECT    9    7   10   33   34                                       
CONECT   10    9   13   32                                            
CONECT   11   12   31                                                 
CONECT   12   11   15   13   13                                       
CONECT   13   10   12   12   14                                       
CONECT   14   13   41   42   43                                       
CONECT   15   12   16   29   30                                       
CONECT   16   15   17   27   28                                       
CONECT   17   16   18                                                 
CONECT   18   17   21   19   20                                       
CONECT   18   20                                                      
CONECT   19   18                                                      
CONECT   20   18   18                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   24   25                                       
CONECT   22   25                                                      
CONECT   23   22   26                                                 
CONECT   24   22                                                      
CONECT   25   22   22                                                 
CONECT   26   23                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29   15                                                      
CONECT   30   15                                                      
CONECT   31   11                                                      
CONECT   32   10                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35    8                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
