COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.168  -1.555   1.443  1.00  0.00           C  
HETATM    2  N   UNL     1       6.082  -0.823   1.316  1.00  0.00           N  
HETATM    3  C   UNL     1       5.276  -0.982   0.271  1.00  0.00           C  
HETATM    4  C   UNL     1       6.770  -2.701  -0.521  1.00  0.00           C  
HETATM    5  C   UNL     1       3.750  -0.998  -1.320  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.037  -2.768   1.443  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.752  -2.596   1.931  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.924  -1.639   1.387  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.378  -0.836   0.336  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.494   0.188  -0.249  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.677  -1.010  -0.157  1.00  0.00           C  
HETATM   12  C   UNL     1       5.600  -1.944  -0.701  1.00  0.00           C  
HETATM   13  N   UNL     1       7.516  -2.468   0.554  1.00  0.00           N  
HETATM   14  N   UNL     1       7.137  -3.668  -1.441  1.00  0.00           N  
HETATM   15  O   UNL     1      -7.129  -0.237  -1.177  1.00  0.00           O  
HETATM   16  O   UNL     1      -8.765  -2.156  -0.071  1.00  0.00           O  
HETATM   17  C   UNL     1       3.373   0.664   0.541  1.00  0.00           C  
HETATM   18  C   UNL     1       3.890   2.050   0.097  1.00  0.00           C  
HETATM   19  C   UNL     1       2.619   2.927   0.048  1.00  0.00           C  
HETATM   20  C   UNL     1       1.484   1.967   0.468  1.00  0.00           C  
HETATM   21  C   UNL     1       0.214   2.262  -0.333  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.502  -1.981   0.403  1.00  0.00           C  
HETATM   23  N   UNL     1       4.626  -1.905  -1.641  1.00  0.00           N  
HETATM   24  N   UNL     1       4.106  -0.401  -0.147  1.00  0.00           N  
HETATM   25  O   UNL     1      -4.892   0.884  -1.162  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.280   1.253  -1.924  1.00  0.00           O  
HETATM   27  O   UNL     1       4.818   2.568   1.053  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.244   0.352   0.228  1.00  0.00           O  
HETATM   29  O   UNL     1       2.723   4.013   0.971  1.00  0.00           O  
HETATM   30  O   UNL     1      -2.993   2.937  -0.184  1.00  0.00           O  
HETATM   31  O   UNL     1       1.981   0.648   0.154  1.00  0.00           O  
HETATM   32  O   UNL     1      -0.854   1.444   0.150  1.00  0.00           O  
HETATM   33  P   UNL     1      -2.342   1.491  -0.464  1.00  0.00           P  
HETATM   34  H   UNL     1       7.802  -1.401   2.304  1.00  0.00           H  
HETATM   35  H   UNL     1       2.869  -0.755  -1.897  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.679  -3.523   1.873  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.399  -3.214   2.743  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.923  -1.509   1.772  1.00  0.00           H  
HETATM   39  H   UNL     1       6.583  -3.829  -2.221  1.00  0.00           H  
HETATM   40  H   UNL     1       7.947  -4.184  -1.306  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.959  -0.605  -2.055  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.431  -1.615   0.374  1.00  0.00           H  
HETATM   43  H   UNL     1       3.467   0.552   1.621  1.00  0.00           H  
HETATM   44  H   UNL     1       4.350   1.988  -0.889  1.00  0.00           H  
HETATM   45  H   UNL     1       2.452   3.301  -0.962  1.00  0.00           H  
HETATM   46  H   UNL     1       1.287   2.056   1.536  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.053   3.312  -0.218  1.00  0.00           H  
HETATM   48  H   UNL     1       0.390   2.045  -1.386  1.00  0.00           H  
HETATM   49  H   UNL     1       5.130   3.461   0.855  1.00  0.00           H  
HETATM   50  H   UNL     1       3.458   4.614   0.790  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.064   3.160   0.755  1.00  0.00           H  
CONECT    1   13    2    2   34                                       
CONECT    2    1    1    3                                            
CONECT    3   12   12    2   24                                       
CONECT    4   14   13   13   12                                       
CONECT    5   23   23   24   35                                       
CONECT    6    7    7   22   36                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7    9    9   38                                       
CONECT    9    8    8   11   10                                       
CONECT   10    9   25   25   28                                       
CONECT   11   22   22    9   15                                       
CONECT   12    4   23    3    3                                       
CONECT   13    4    4    1                                            
CONECT   14    4   39   40                                            
CONECT   15   11   41                                                 
CONECT   16   22   42                                                 
CONECT   17   24   18   31   43                                       
CONECT   18   19   17   27   44                                       
CONECT   19   18   29   20   45                                       
CONECT   20   19   31   21   46                                       
CONECT   21   20   32   47   48                                       
CONECT   22    6   16   11   11                                       
CONECT   23   12    5    5                                            
CONECT   24    3    5   17                                            
CONECT   25   10   10                                                 
CONECT   26   33   33                                                 
CONECT   27   18   49                                                 
CONECT   28   10   33                                                 
CONECT   29   19   50                                                 
CONECT   30   33   51                                                 
CONECT   31   17   20                                                 
CONECT   32   21   33                                                 
CONECT   33   28   32   26   26                                       
CONECT   33   30                                                      
CONECT   34    1                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
