COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.874  -1.090  -0.839  1.00  0.00           C  
HETATM    2  C   UNL     1       4.720  -0.606   0.462  1.00  0.00           C  
HETATM    3  C   UNL     1       4.297  -1.482   1.442  1.00  0.00           C  
HETATM    4  N   UNL     1       4.052  -2.744   1.119  1.00  0.00           N  
HETATM    5  N   UNL     1       4.608  -2.370  -1.084  1.00  0.00           N  
HETATM    6  O   UNL     1      -6.261  -1.470  -1.258  1.00  0.00           O  
HETATM    7  P   UNL     1      -5.787  -0.992   0.205  1.00  0.00           P  
HETATM    8  O   UNL     1      -6.543   0.218   0.597  1.00  0.00           O  
HETATM    9  O   UNL     1      -6.064  -2.167   1.270  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.213  -0.655   0.175  1.00  0.00           O  
HETATM   11  P   UNL     1      -3.350   0.612  -0.318  1.00  0.00           P  
HETATM   12  O   UNL     1      -3.292   0.629  -1.927  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.983   1.859   0.166  1.00  0.00           O  
HETATM   14  O   UNL     1      -1.856   0.505   0.271  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.876   1.531   0.099  1.00  0.00           C  
HETATM   16  C   UNL     1       0.428   1.110   0.781  1.00  0.00           C  
HETATM   17  C   UNL     1       1.477   2.209   0.596  1.00  0.00           C  
HETATM   18  C   UNL     1       2.778   1.823   1.271  1.00  0.00           C  
HETATM   19  C   UNL     1       2.872   1.656   2.577  1.00  0.00           C  
HETATM   20  S   UNL     1       1.946   2.365  -1.171  1.00  0.00           S  
HETATM   21  C   UNL     1       3.755   2.374  -0.855  1.00  0.00           C  
HETATM   22  N   UNL     1       3.852   1.660   0.432  1.00  0.00           N  
HETATM   23  C   UNL     1       5.010   0.837   0.788  1.00  0.00           C  
HETATM   24  C   UNL     1       4.207  -3.171  -0.118  1.00  0.00           C  
HETATM   25  C   UNL     1       3.916  -4.615  -0.437  1.00  0.00           C  
HETATM   26  N   UNL     1       5.290  -0.249  -1.858  1.00  0.00           N  
HETATM   27  H   UNL     1       4.168  -1.143   2.459  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.806  -2.260  -1.580  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.994  -2.422   1.341  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.888  -0.160  -2.314  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.696   1.687  -0.964  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.237   2.457   0.546  1.00  0.00           H  
HETATM   33  H   UNL     1       0.248   0.955   1.844  1.00  0.00           H  
HETATM   34  H   UNL     1       0.789   0.184   0.334  1.00  0.00           H  
HETATM   35  H   UNL     1       1.108   3.159   0.982  1.00  0.00           H  
HETATM   36  H   UNL     1       3.818   1.381   3.019  1.00  0.00           H  
HETATM   37  H   UNL     1       2.002   1.794   3.203  1.00  0.00           H  
HETATM   38  H   UNL     1       4.288   1.836  -1.638  1.00  0.00           H  
HETATM   39  H   UNL     1       4.128   3.394  -0.765  1.00  0.00           H  
HETATM   40  H   UNL     1       5.211   0.935   1.855  1.00  0.00           H  
HETATM   41  H   UNL     1       5.880   1.170   0.223  1.00  0.00           H  
HETATM   42  H   UNL     1       2.868  -4.720  -0.719  1.00  0.00           H  
HETATM   43  H   UNL     1       4.549  -4.939  -1.263  1.00  0.00           H  
HETATM   44  H   UNL     1       4.120  -5.228   0.440  1.00  0.00           H  
HETATM   45  H   UNL     1       5.250  -0.548  -2.780  1.00  0.00           H  
HETATM   46  H   UNL     1       5.622   0.638  -1.650  1.00  0.00           H  
CONECT    1    2    2    5   26                                       
CONECT    2   23    3    1    1                                       
CONECT    3    4    4    2   27                                       
CONECT    4    3    3   24                                            
CONECT    5   24   24    1                                            
CONECT    6    7   28                                                 
CONECT    7    8    8   10    9                                       
CONECT    7    6                                                      
CONECT    8    7    7                                                 
CONECT    9    7   29                                                 
CONECT   10   11    7                                                 
CONECT   11   14   13   13   10                                       
CONECT   11   12                                                      
CONECT   12   11   30                                                 
CONECT   13   11   11                                                 
CONECT   14   15   11                                                 
CONECT   15   16   14   31   32                                       
CONECT   16   17   15   33   34                                       
CONECT   17   18   16   20   35                                       
CONECT   18   19   19   22   17                                       
CONECT   19   18   18   36   37                                       
CONECT   20   17   21                                                 
CONECT   21   22   20   38   39                                       
CONECT   22   18   23   21                                            
CONECT   23   22    2   40   41                                       
CONECT   24    4   25    5    5                                       
CONECT   25   24   42   43   44                                       
CONECT   26    1   45   46                                            
CONECT   27    3                                                      
CONECT   28    6                                                      
CONECT   29    9                                                      
CONECT   30   12                                                      
CONECT   31   15                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
