COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.600  -2.251  -0.479  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.428  -1.950  -0.351  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.863  -0.815  -0.805  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.556   0.253  -1.530  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.093   1.261  -0.546  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.315   2.339  -0.167  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.807   3.263   0.735  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.077   3.109   1.259  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.855   2.031   0.880  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.365   1.110  -0.027  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.520  -0.826  -0.474  1.00  0.00           C  
HETATM   12  N   UNL     1       0.487   0.019  -0.670  1.00  0.00           N  
HETATM   13  C   UNL     1       1.700  -0.266  -0.227  1.00  0.00           C  
HETATM   14  N   UNL     1       1.967  -1.388   0.422  1.00  0.00           N  
HETATM   15  C   UNL     1       1.011  -2.286   0.658  1.00  0.00           C  
HETATM   16  N   UNL     1       1.295  -3.460   1.339  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.281  -2.020   0.206  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.497  -2.700   0.272  1.00  0.00           N  
HETATM   19  O   UNL     1       2.703   0.619  -0.445  1.00  0.00           O  
HETATM   20  C   UNL     1       3.996   0.269   0.051  1.00  0.00           C  
HETATM   21  C   UNL     1       4.990   1.382  -0.288  1.00  0.00           C  
HETATM   22  C   UNL     1       6.376   1.008   0.243  1.00  0.00           C  
HETATM   23  C   UNL     1       7.370   2.120  -0.095  1.00  0.00           C  
HETATM   24  H   UNL     1      -1.859   0.743  -2.209  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.381  -0.172  -2.102  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.322   2.458  -0.576  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.199   4.105   1.032  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.461   3.831   1.964  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.847   1.911   1.289  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.973   0.268  -0.324  1.00  0.00           H  
HETATM   31  H   UNL     1       2.198  -3.635   1.649  1.00  0.00           H  
HETATM   32  H   UNL     1       0.592  -4.107   1.505  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.646  -3.561   0.692  1.00  0.00           H  
HETATM   34  H   UNL     1       3.948   0.142   1.132  1.00  0.00           H  
HETATM   35  H   UNL     1       4.323  -0.663  -0.411  1.00  0.00           H  
HETATM   36  H   UNL     1       5.038   1.510  -1.369  1.00  0.00           H  
HETATM   37  H   UNL     1       4.664   2.314   0.174  1.00  0.00           H  
HETATM   38  H   UNL     1       6.328   0.880   1.325  1.00  0.00           H  
HETATM   39  H   UNL     1       6.702   0.076  -0.218  1.00  0.00           H  
HETATM   40  H   UNL     1       7.418   2.248  -1.177  1.00  0.00           H  
HETATM   41  H   UNL     1       7.043   3.052   0.366  1.00  0.00           H  
HETATM   42  H   UNL     1       8.356   1.854   0.283  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   18    3    1    1                                       
CONECT    3   11    4    2                                            
CONECT    4    5    3   24   25                                       
CONECT    5   10   10    6    4                                       
CONECT    6    7    7    5   26                                       
CONECT    7    8    6    6   27                                       
CONECT    8    9    9    7   28                                       
CONECT    9    8    8   10   29                                       
CONECT   10    9    5    5   30                                       
CONECT   11   12   12   17    3                                       
CONECT   12   13   11   11                                            
CONECT   13   19   14   14   12                                       
CONECT   14   13   13   15                                            
CONECT   15   14   16   17   17                                       
CONECT   16   15   31   32                                            
CONECT   17   15   15   11   18                                       
CONECT   18   17    2   33                                            
CONECT   19   20   13                                                 
CONECT   20   19   21   34   35                                       
CONECT   21   20   22   36   37                                       
CONECT   22   21   23   38   39                                       
CONECT   23   22   40   41   42                                       
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   16                                                      
CONECT   32   16                                                      
CONECT   33   18                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
