COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       8.813   3.764   0.602  1.00  0.00           N  
HETATM    2  C   UNL     1       8.507   2.527   0.064  1.00  0.00           C  
HETATM    3  N   UNL     1       9.416   1.839  -0.620  1.00  0.00           N  
HETATM    4  C   UNL     1       9.133   0.658  -1.137  1.00  0.00           C  
HETATM    5  N   UNL     1       7.949   0.096  -1.011  1.00  0.00           N  
HETATM    6  C   UNL     1       6.976   0.709  -0.344  1.00  0.00           C  
HETATM    7  N   UNL     1       5.673   0.409  -0.038  1.00  0.00           N  
HETATM    8  C   UNL     1       5.173   1.450   0.685  1.00  0.00           C  
HETATM    9  N   UNL     1       6.086   2.364   0.839  1.00  0.00           N  
HETATM   10  C   UNL     1       7.229   1.966   0.231  1.00  0.00           C  
HETATM   11  C   UNL     1       4.952  -0.808  -0.419  1.00  0.00           C  
HETATM   12  O   UNL     1       3.526  -0.577  -0.392  1.00  0.00           O  
HETATM   13  C   UNL     1       2.930  -1.887  -0.284  1.00  0.00           C  
HETATM   14  C   UNL     1       1.502  -1.780   0.255  1.00  0.00           C  
HETATM   15  O   UNL     1       0.680  -1.112  -0.703  1.00  0.00           O  
HETATM   16  P   UNL     1      -0.800  -1.034  -0.072  1.00  0.00           P  
HETATM   17  O   UNL     1      -1.395  -2.522   0.084  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.737  -0.385   1.256  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.753  -0.175  -1.045  1.00  0.00           O  
HETATM   20  P   UNL     1      -3.004   0.314  -0.157  1.00  0.00           P  
HETATM   21  O   UNL     1      -2.574   1.596   0.716  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.425  -0.780   0.747  1.00  0.00           O  
HETATM   23  O   UNL     1      -4.228   0.710  -1.125  1.00  0.00           O  
HETATM   24  P   UNL     1      -5.543   0.799  -0.201  1.00  0.00           P  
HETATM   25  O   UNL     1      -5.565   2.214   0.566  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.525  -0.300   0.790  1.00  0.00           O  
HETATM   27  O   UNL     1      -6.856   0.668  -1.123  1.00  0.00           O  
HETATM   28  P   UNL     1      -8.090   0.364  -0.134  1.00  0.00           P  
HETATM   29  O   UNL     1      -8.585   1.738   0.545  1.00  0.00           O  
HETATM   30  O   UNL     1      -9.302  -0.286  -0.972  1.00  0.00           O  
HETATM   31  O   UNL     1      -7.657  -0.579   0.920  1.00  0.00           O  
HETATM   32  C   UNL     1       3.829  -2.649   0.714  1.00  0.00           C  
HETATM   33  O   UNL     1       3.962  -4.018   0.325  1.00  0.00           O  
HETATM   34  C   UNL     1       5.192  -1.924   0.622  1.00  0.00           C  
HETATM   35  O   UNL     1       6.209  -2.823   0.176  1.00  0.00           O  
HETATM   36  H   UNL     1       9.699   4.140   0.483  1.00  0.00           H  
HETATM   37  H   UNL     1       8.139   4.259   1.096  1.00  0.00           H  
HETATM   38  H   UNL     1       9.901   0.133  -1.686  1.00  0.00           H  
HETATM   39  H   UNL     1       4.166   1.508   1.073  1.00  0.00           H  
HETATM   40  H   UNL     1       5.264  -1.139  -1.409  1.00  0.00           H  
HETATM   41  H   UNL     1       2.932  -2.386  -1.254  1.00  0.00           H  
HETATM   42  H   UNL     1       1.107  -2.779   0.439  1.00  0.00           H  
HETATM   43  H   UNL     1       1.508  -1.215   1.187  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.419  -2.908  -0.802  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.308   2.284   0.091  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.576   2.901  -0.114  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.857   2.323  -0.175  1.00  0.00           H  
HETATM   48  H   UNL     1     -10.018  -0.452  -0.344  1.00  0.00           H  
HETATM   49  H   UNL     1       3.424  -2.578   1.724  1.00  0.00           H  
HETATM   50  H   UNL     1       4.531  -4.441   0.982  1.00  0.00           H  
HETATM   51  H   UNL     1       5.461  -1.493   1.587  1.00  0.00           H  
HETATM   52  H   UNL     1       6.269  -3.527   0.836  1.00  0.00           H  
CONECT    1    2   36   37                                            
CONECT    2    1    3    3   10                                       
CONECT    3    2    2    4                                            
CONECT    4    3    5    5   38                                       
CONECT    5    4    4    6                                            
CONECT    6    5    7   10   10                                       
CONECT    7    6    8   11                                            
CONECT    8    7    9    9   39                                       
CONECT    9    8    8   10                                            
CONECT   10    2    6    6    9                                       
CONECT   11    7   12   34   40                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   32   41                                       
CONECT   14   13   15   42   43                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   18   18                                       
CONECT   16   19                                                      
CONECT   17   16   44                                                 
CONECT   18   16   16                                                 
CONECT   19   16   20                                                 
CONECT   20   19   21   22   22                                       
CONECT   20   23                                                      
CONECT   21   20   45                                                 
CONECT   22   20   20                                                 
CONECT   23   20   24                                                 
CONECT   24   23   25   26   26                                       
CONECT   24   27                                                      
CONECT   25   24   46                                                 
CONECT   26   24   24                                                 
CONECT   27   24   28                                                 
CONECT   28   27   29   30   31                                       
CONECT   28   31                                                      
CONECT   29   28   47                                                 
CONECT   30   28   48                                                 
CONECT   31   28   28                                                 
CONECT   32   13   33   34   49                                       
CONECT   33   32   50                                                 
CONECT   34   11   32   35   51                                       
CONECT   35   34   52                                                 
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    8                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   21                                                      
CONECT   46   25                                                      
CONECT   47   29                                                      
CONECT   48   30                                                      
CONECT   49   32                                                      
CONECT   50   33                                                      
CONECT   51   34                                                      
CONECT   52   35                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
