COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.302  -1.057  -2.732  1.00  0.00           N  
HETATM    2  C   UNL     1      -7.785  -0.988  -1.723  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.134  -0.902  -0.451  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.866  -1.082   0.725  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.236  -0.999   1.950  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.880  -0.737   2.019  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.765  -0.643  -0.381  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.143  -0.556   0.854  1.00  0.00           C  
HETATM    9  N   UNL     1      -3.771  -0.290   0.930  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.187   0.504   0.011  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.867   1.067  -0.826  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.722   0.691   0.020  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.941   0.040   0.978  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.116   1.515  -0.932  1.00  0.00           C  
HETATM   15  C   UNL     1       0.249   1.688  -0.922  1.00  0.00           C  
HETATM   16  C   UNL     1       1.028   1.042   0.038  1.00  0.00           C  
HETATM   17  C   UNL     1       0.425   0.215   0.986  1.00  0.00           C  
HETATM   18  C   UNL     1       2.499   1.229   0.048  1.00  0.00           C  
HETATM   19  C   UNL     1       3.342   0.125  -0.027  1.00  0.00           C  
HETATM   20  C   UNL     1       4.724   0.309  -0.018  1.00  0.00           C  
HETATM   21  C   UNL     1       5.628  -0.858  -0.098  1.00  0.00           C  
HETATM   22  O   UNL     1       6.975  -0.828  -0.099  1.00  0.00           O  
HETATM   23  C   UNL     1       7.383  -2.105  -0.184  1.00  0.00           C  
HETATM   24  C   UNL     1       8.812  -2.583  -0.219  1.00  0.00           C  
HETATM   25  N   UNL     1       6.319  -2.857  -0.231  1.00  0.00           N  
HETATM   26  N   UNL     1       5.267  -2.118  -0.175  1.00  0.00           N  
HETATM   27  C   UNL     1       5.252   1.599   0.065  1.00  0.00           C  
HETATM   28  C   UNL     1       4.409   2.690   0.139  1.00  0.00           C  
HETATM   29  C   UNL     1       3.039   2.513   0.126  1.00  0.00           C  
HETATM   30  C   UNL     1       2.126   3.709   0.206  1.00  0.00           C  
HETATM   31  H   UNL     1      -8.925  -1.287   0.675  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.804  -1.139   2.858  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.393  -0.672   2.980  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.192  -0.507  -1.287  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.241  -0.678   1.643  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.408  -0.600   1.712  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.719   2.014  -1.676  1.00  0.00           H  
HETATM   38  H   UNL     1       0.718   2.324  -1.658  1.00  0.00           H  
HETATM   39  H   UNL     1       1.029  -0.288   1.727  1.00  0.00           H  
HETATM   40  H   UNL     1       2.928  -0.870  -0.092  1.00  0.00           H  
HETATM   41  H   UNL     1       9.158  -2.766   0.798  1.00  0.00           H  
HETATM   42  H   UNL     1       8.872  -3.507  -0.795  1.00  0.00           H  
HETATM   43  H   UNL     1       9.438  -1.823  -0.685  1.00  0.00           H  
HETATM   44  H   UNL     1       6.323   1.743   0.073  1.00  0.00           H  
HETATM   45  H   UNL     1       4.822   3.685   0.204  1.00  0.00           H  
HETATM   46  H   UNL     1       1.832   4.010  -0.799  1.00  0.00           H  
HETATM   47  H   UNL     1       1.238   3.451   0.783  1.00  0.00           H  
HETATM   48  H   UNL     1       2.649   4.533   0.693  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    1    1    1    3                                       
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6    6   32                                       
CONECT    6    5    5    8   33                                       
CONECT    7    3    8    8   34                                       
CONECT    8    7    7    6    9                                       
CONECT    9    8   10   35                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   13   14                                       
CONECT   13   12   12   17   36                                       
CONECT   14   12   15   15   37                                       
CONECT   15   14   14   16   38                                       
CONECT   16   17   17   18   15                                       
CONECT   17   13   16   16   39                                       
CONECT   18   29   16   19   19                                       
CONECT   19   18   18   20   40                                       
CONECT   20   27   27   19   21                                       
CONECT   21   20   22   26   26                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   25   25                                       
CONECT   24   23   41   42   43                                       
CONECT   25   26   23   23                                            
CONECT   26   21   21   25                                            
CONECT   27   28   20   20   44                                       
CONECT   28   29   29   27   45                                       
CONECT   29   30   28   28   18                                       
CONECT   30   29   46   47   48                                       
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   24                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
