COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.388   2.043  -0.033  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.823   0.487  -0.018  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.208   0.739  -0.030  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.184   1.686  -0.013  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.131   2.661  -0.022  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.279  -0.288  -0.038  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.957  -1.575  -0.034  1.00  0.00           N  
HETATM    8  N   UNL     1       0.197   1.882  -0.001  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.882   4.104  -0.022  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.878  -2.517  -0.040  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.615   0.108  -0.044  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.222  -2.196  -0.052  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.603  -0.861  -0.052  1.00  0.00           C  
HETATM   14  C   UNL     1       2.489   1.028   0.019  1.00  0.00           C  
HETATM   15  C   UNL     1       3.528  -0.009   0.029  1.00  0.00           C  
HETATM   16  C   UNL     1       4.705   0.686   0.033  1.00  0.00           C  
HETATM   17  N   UNL     1       4.395   1.997   0.026  1.00  0.00           N  
HETATM   18  N   UNL     1       3.126   2.182   0.019  1.00  0.00           N  
HETATM   19  C   UNL     1       5.385   3.077   0.028  1.00  0.00           C  
HETATM   20  C   UNL     1       3.343  -1.480   0.034  1.00  0.00           C  
HETATM   21  C   UNL     1       1.028   0.821   0.007  1.00  0.00           C  
HETATM   22  O   UNL     1       0.573  -0.307   0.003  1.00  0.00           O  
HETATM   23  C   UNL     1       4.023  -2.293  -0.879  1.00  0.00           C  
HETATM   24  C   UNL     1       3.821  -3.657  -0.839  1.00  0.00           C  
HETATM   25  N   UNL     1       3.001  -4.195   0.043  1.00  0.00           N  
HETATM   26  C   UNL     1       2.340  -3.464   0.920  1.00  0.00           C  
HETATM   27  C   UNL     1       2.488  -2.094   0.954  1.00  0.00           C  
HETATM   28  H   UNL     1      -1.353  -0.485  -0.013  1.00  0.00           H  
HETATM   29  H   UNL     1       0.559   2.782   0.002  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.829   4.464   1.006  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.938   4.310  -0.528  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.692   4.613  -0.543  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.578  -3.555  -0.037  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.876   1.156  -0.043  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.969  -2.976  -0.058  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.647  -0.585  -0.057  1.00  0.00           H  
HETATM   37  H   UNL     1       5.699   0.263   0.040  1.00  0.00           H  
HETATM   38  H   UNL     1       5.636   3.341  -0.999  1.00  0.00           H  
HETATM   39  H   UNL     1       4.971   3.948   0.536  1.00  0.00           H  
HETATM   40  H   UNL     1       6.283   2.746   0.549  1.00  0.00           H  
HETATM   41  H   UNL     1       4.696  -1.859  -1.603  1.00  0.00           H  
HETATM   42  H   UNL     1       4.342  -4.293  -1.540  1.00  0.00           H  
HETATM   43  H   UNL     1       1.678  -3.947   1.624  1.00  0.00           H  
HETATM   44  H   UNL     1       1.947  -1.502   1.679  1.00  0.00           H  
CONECT    1    3    3    5                                            
CONECT    2    3    4    4   28                                       
CONECT    3    1    1    2    6                                       
CONECT    4    2    2    5    8                                       
CONECT    5    1    4    9                                            
CONECT    6    3    7    7   11                                       
CONECT    7    6    6   10                                            
CONECT    8    4   21   29                                            
CONECT    9    5   30   31   32                                       
CONECT   10    7   12   12   33                                       
CONECT   11    6   13   13   34                                       
CONECT   12   10   10   13   35                                       
CONECT   13   11   11   12   36                                       
CONECT   14   15   18   18   21                                       
CONECT   15   14   16   16   20                                       
CONECT   16   15   15   17   37                                       
CONECT   17   16   18   19                                            
CONECT   18   14   14   17                                            
CONECT   19   17   38   39   40                                       
CONECT   20   15   23   23   27                                       
CONECT   21    8   14   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   20   20   24   41                                       
CONECT   24   23   25   25   42                                       
CONECT   25   24   24   26                                            
CONECT   26   25   27   27   43                                       
CONECT   27   20   26   26   44                                       
CONECT   28    2                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   26                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
