COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.648  -1.727   0.179  1.00  0.00           N  
HETATM    2  C   UNL     1       3.483  -2.182  -0.364  1.00  0.00           C  
HETATM    3  N   UNL     1       3.346  -3.524  -0.619  1.00  0.00           N  
HETATM    4  N   UNL     1       2.488  -1.376  -0.650  1.00  0.00           N  
HETATM    5  C   UNL     1       2.578  -0.052  -0.417  1.00  0.00           C  
HETATM    6  C   UNL     1       3.752   0.465   0.140  1.00  0.00           C  
HETATM    7  C   UNL     1       4.809  -0.411   0.441  1.00  0.00           C  
HETATM    8  O   UNL     1       5.846   0.007   0.927  1.00  0.00           O  
HETATM    9  N   UNL     1       3.553   1.827   0.261  1.00  0.00           N  
HETATM   10  C   UNL     1       2.315   2.090  -0.206  1.00  0.00           C  
HETATM   11  N   UNL     1       1.744   0.985  -0.603  1.00  0.00           N1+
HETATM   12  C   UNL     1      -2.010   0.388  -0.393  1.00  0.00           C  
HETATM   13  O   UNL     1      -6.021  -0.037  -1.311  1.00  0.00           O  
HETATM   14  C   UNL     1      -5.234  -0.426   1.373  1.00  0.00           C  
HETATM   15  N   UNL     1      -4.809  -0.604   2.640  1.00  0.00           N  
HETATM   16  O   UNL     1      -6.414  -0.547   1.105  1.00  0.00           O  
HETATM   17  C   UNL     1      -4.708   0.102  -1.009  1.00  0.00           C  
HETATM   18  C   UNL     1       0.396   0.890  -1.169  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.584   0.541  -0.078  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.194   0.387   1.060  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.461   0.566  -1.709  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.917   0.060   0.617  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.796   0.423  -2.008  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.267  -0.085   0.311  1.00  0.00           C  
HETATM   25  C   UNL     1       4.507   2.802   0.796  1.00  0.00           C  
HETATM   26  H   UNL     1       5.362  -2.351   0.383  1.00  0.00           H  
HETATM   27  H   UNL     1       4.073  -4.134  -0.413  1.00  0.00           H  
HETATM   28  H   UNL     1       2.524  -3.864  -1.005  1.00  0.00           H  
HETATM   29  H   UNL     1       1.863   3.070  -0.245  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.275  -0.937  -1.558  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.444  -0.829   3.337  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.868  -0.508   2.853  1.00  0.00           H  
HETATM   33  H   UNL     1       0.120   1.846  -1.613  1.00  0.00           H  
HETATM   34  H   UNL     1       0.377   0.115  -1.935  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.758   0.816  -2.489  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.572  -0.082   1.630  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.138   0.566  -3.023  1.00  0.00           H  
HETATM   38  H   UNL     1       5.129   3.184  -0.014  1.00  0.00           H  
HETATM   39  H   UNL     1       3.964   3.627   1.256  1.00  0.00           H  
HETATM   40  H   UNL     1       5.138   2.320   1.543  1.00  0.00           H  
CONECT    1    2    7   26                                            
CONECT    2    1    3    4    4                                       
CONECT    3    2   27   28                                            
CONECT    4    2    2    5                                            
CONECT    5    4    6    6   11                                       
CONECT    6    5    5    7    9                                       
CONECT    7    1    6    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    6   10   25                                            
CONECT   10    9   11   11   29                                       
CONECT   11    5   10   10   18                                       
CONECT   12   19   21   21   22                                       
CONECT   13   17   30                                                 
CONECT   14   15   16   16   24                                       
CONECT   15   14   31   32                                            
CONECT   16   14   14                                                 
CONECT   17   13   23   23   24                                       
CONECT   18   11   19   33   34                                       
CONECT   19   12   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   12   12   23   35                                       
CONECT   22   12   24   24   36                                       
CONECT   23   17   17   21   37                                       
CONECT   24   14   17   22   22                                       
CONECT   25    9   38   39   40                                       
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29   10                                                      
CONECT   30   13                                                      
CONECT   31   15                                                      
CONECT   32   15                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
CONECT   38   25                                                      
CONECT   39   25                                                      
CONECT   40   25                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
