COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.267  -0.078  -0.049  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.290   0.886  -0.041  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.978   2.280  -0.137  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.946   0.321  -0.148  1.00  0.00           N  
HETATM    5  C   UNL     1      -4.079  -3.267   0.251  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.619   0.458   0.061  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.751   1.452   0.072  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.561  -1.366   0.045  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.806  -1.788   0.148  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.867  -0.900   0.151  1.00  0.00           C  
HETATM   11  H   UNL     1      -0.727   1.263  -0.213  1.00  0.00           H  
HETATM   12  H   UNL     1      -4.082  -3.563   1.300  1.00  0.00           H  
HETATM   13  H   UNL     1      -5.051  -3.489  -0.191  1.00  0.00           H  
HETATM   14  H   UNL     1      -3.304  -3.818  -0.280  1.00  0.00           H  
HETATM   15  H   UNL     1      -6.085   1.635  -0.949  1.00  0.00           H  
HETATM   16  H   UNL     1      -6.579   1.054   0.659  1.00  0.00           H  
HETATM   17  H   UNL     1      -5.409   2.388   0.516  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.881  -1.264   0.227  1.00  0.00           H  
HETATM   19  N   UNL     1      -2.731   3.386  -0.214  1.00  0.00           N  
HETATM   20  C   UNL     1       0.123  -0.681  -0.156  1.00  0.00           C  
HETATM   21  C   UNL     1       1.478   0.020  -0.275  1.00  0.00           C  
HETATM   22  C   UNL     1       2.594  -1.027  -0.283  1.00  0.00           C  
HETATM   23  N   UNL     1       3.895  -0.354  -0.396  1.00  0.00           N  
HETATM   24  C   UNL     1       4.999  -1.298  -0.170  1.00  0.00           C  
HETATM   25  C   UNL     1       6.333  -0.571  -0.357  1.00  0.00           C  
HETATM   26  O   UNL     1       6.388   0.548   0.532  1.00  0.00           O  
HETATM   27  C   UNL     1       5.328   1.489   0.339  1.00  0.00           C  
HETATM   28  C   UNL     1       3.984   0.782   0.532  1.00  0.00           C  
HETATM   29  H   UNL     1       0.090  -1.255   0.770  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.014  -1.352  -1.004  1.00  0.00           H  
HETATM   31  H   UNL     1       1.511   0.593  -1.201  1.00  0.00           H  
HETATM   32  H   UNL     1       1.615   0.691   0.573  1.00  0.00           H  
HETATM   33  H   UNL     1       2.562  -1.600   0.644  1.00  0.00           H  
HETATM   34  H   UNL     1       2.457  -1.698  -1.131  1.00  0.00           H  
HETATM   35  H   UNL     1       4.938  -1.693   0.844  1.00  0.00           H  
HETATM   36  H   UNL     1       4.928  -2.118  -0.885  1.00  0.00           H  
HETATM   37  H   UNL     1       7.153  -1.253  -0.134  1.00  0.00           H  
HETATM   38  H   UNL     1       6.417  -0.223  -1.386  1.00  0.00           H  
HETATM   39  H   UNL     1       5.422   2.297   1.064  1.00  0.00           H  
HETATM   40  H   UNL     1       5.383   1.897  -0.670  1.00  0.00           H  
HETATM   41  H   UNL     1       3.172   1.482   0.330  1.00  0.00           H  
HETATM   42  H   UNL     1       3.907   0.421   1.558  1.00  0.00           H  
CONECT    1    4    8    2    2                                       
CONECT    2    1    1    3    6                                       
CONECT    3    2   19   19   19                                       
CONECT    4    1   11   20                                            
CONECT    5    9   12   13   14                                       
CONECT    6    2   10   10    7                                       
CONECT    7    6   15   16   17                                       
CONECT    8    1    9    9                                            
CONECT    9    8    8    5   10                                       
CONECT   10    9    6    6   18                                       
CONECT   11    4                                                      
CONECT   12    5                                                      
CONECT   13    5                                                      
CONECT   14    5                                                      
CONECT   15    7                                                      
CONECT   16    7                                                      
CONECT   17    7                                                      
CONECT   18   10                                                      
CONECT   19    3    3    3                                            
CONECT   20    4   21   29   30                                       
CONECT   21   20   22   31   32                                       
CONECT   22   21   23   33   34                                       
CONECT   23   22   24   28                                            
CONECT   24   23   25   35   36                                       
CONECT   25   24   26   37   38                                       
CONECT   26   25   27                                                 
CONECT   27   26   28   39   40                                       
CONECT   28   27   23   41   42                                       
CONECT   29   20                                                      
CONECT   30   20                                                      
CONECT   31   21                                                      
CONECT   32   21                                                      
CONECT   33   22                                                      
CONECT   34   22                                                      
CONECT   35   24                                                      
CONECT   36   24                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
CONECT   39   27                                                      
CONECT   40   27                                                      
CONECT   41   28                                                      
CONECT   42   28                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
