COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.143  -1.807   0.237  1.00  0.00           O  
HETATM    2  C   UNL     1       1.813  -0.691  -0.115  1.00  0.00           C  
HETATM    3  C   UNL     1       2.813   0.395  -0.161  1.00  0.00           C  
HETATM    4  C   UNL     1       4.117   0.174   0.310  1.00  0.00           C  
HETATM    5  N   UNL     1       4.471  -1.062   0.820  1.00  0.00           N  
HETATM    6  N   UNL     1       5.009   1.157   0.264  1.00  0.00           N  
HETATM    7  C   UNL     1       4.667   2.335  -0.224  1.00  0.00           C  
HETATM    8  C   UNL     1       3.378   2.554  -0.690  1.00  0.00           C  
HETATM    9  N   UNL     1       2.485   1.586  -0.655  1.00  0.00           N  
HETATM   10  N   UNL     1       0.536  -0.446  -0.469  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.431  -1.452  -0.345  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.097  -2.778  -0.562  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.005  -3.730  -0.446  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.256  -3.466  -0.123  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.672  -2.171   0.110  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.749  -1.133   0.006  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.129   0.188   0.234  1.00  0.00           N  
HETATM   18  C   UNL     1      -2.560   0.380   1.624  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.830   1.865   1.876  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.917   2.352   0.913  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.176   0.604  -0.709  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.464   2.096  -0.527  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.526   2.507  -1.455  1.00  0.00           N  
HETATM   24  H   UNL     1       3.844  -1.801   0.782  1.00  0.00           H  
HETATM   25  H   UNL     1       5.348  -1.191   1.216  1.00  0.00           H  
HETATM   26  H   UNL     1       5.394   3.133  -0.261  1.00  0.00           H  
HETATM   27  H   UNL     1       3.108   3.520  -1.091  1.00  0.00           H  
HETATM   28  H   UNL     1       0.286   0.428  -0.809  1.00  0.00           H  
HETATM   29  H   UNL     1       0.917  -3.037  -0.829  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.966  -4.276  -0.039  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.697  -1.965   0.379  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.471  -0.190   1.804  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.776   0.034   2.298  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.164   2.006   2.904  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.915   2.435   1.710  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.843   1.809   1.106  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.082   3.419   1.059  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.839   0.421  -1.729  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.084   0.033  -0.518  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.559   2.669  -0.731  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.736   3.488  -1.352  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.277   2.289  -2.408  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   10    3    1    1                                       
CONECT    3    9    2    4    4                                       
CONECT    4    3    3    6    5                                       
CONECT    5    4   24   25                                            
CONECT    6    7    7    4                                            
CONECT    7    8    6    6   26                                       
CONECT    8    9    9    7   27                                       
CONECT    9    8    8    3                                            
CONECT   10   11    2   28                                            
CONECT   11   16   10   12   12                                       
CONECT   12   11   11   13   29                                       
CONECT   13   14   14   12                                            
CONECT   14   15   13   13   30                                       
CONECT   15   16   16   14   31                                       
CONECT   16   17   15   15   11                                       
CONECT   17   21   18   16                                            
CONECT   18   19   17   32   33                                       
CONECT   19   20   18   34   35                                       
CONECT   20   22   19   36   37                                       
CONECT   21   22   17   38   39                                       
CONECT   22   23   20   21   40                                       
CONECT   23   22   41   42                                            
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28   10                                                      
CONECT   29   12                                                      
CONECT   30   14                                                      
CONECT   31   15                                                      
CONECT   32   18                                                      
CONECT   33   18                                                      
CONECT   34   19                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
