COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.107   2.196  -1.327  1.00  0.00           C  
HETATM    2  C   UNL     1       1.918   1.980  -1.999  1.00  0.00           C  
HETATM    3  C   UNL     1       1.179   0.841  -1.753  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.863   2.139   0.364  1.00  0.00           N  
HETATM    5  C   UNL     1       1.631  -0.096  -0.825  1.00  0.00           C  
HETATM    6  C   UNL     1       2.829   0.121  -0.149  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.563  -0.492  -0.119  1.00  0.00           N  
HETATM    8  C   UNL     1       0.838  -1.321  -0.559  1.00  0.00           C  
HETATM    9  C   UNL     1       1.289  -2.597  -0.550  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.873  -2.763  -0.080  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.172  -3.160   0.226  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.145  -2.188   0.352  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.805  -0.845   0.171  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.851   0.199   0.308  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.125   3.579   0.306  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.809   1.143   0.635  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.211  -0.018   0.602  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.671   1.544   0.161  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.601  -1.396  -0.249  1.00  0.00           C  
HETATM   20  O   UNL     1       0.280  -3.437  -0.269  1.00  0.00           O  
HETATM   21  C   UNL     1       3.564   1.268  -0.401  1.00  0.00           C  
HETATM   22  O   UNL     1       4.736   1.481   0.252  1.00  0.00           O  
HETATM   23  C   UNL     1       5.088   0.547   1.275  1.00  0.00           C  
HETATM   24  C   UNL     1       5.795  -0.656   0.646  1.00  0.00           C  
HETATM   25  C   UNL     1       6.024   1.220   2.281  1.00  0.00           C  
HETATM   26  H   UNL     1       3.684   3.087  -1.526  1.00  0.00           H  
HETATM   27  H   UNL     1       1.567   2.706  -2.718  1.00  0.00           H  
HETATM   28  H   UNL     1       0.250   0.676  -2.279  1.00  0.00           H  
HETATM   29  H   UNL     1       3.183  -0.602   0.571  1.00  0.00           H  
HETATM   30  H   UNL     1       2.309  -2.896  -0.741  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.414  -4.204   0.361  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.162  -2.464   0.588  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.985   4.014   1.296  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.436   4.046  -0.397  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.150   3.749  -0.023  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.677  -0.977   0.776  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.741   2.042  -0.070  1.00  0.00           H  
HETATM   38  H   UNL     1       4.186   0.211   1.786  1.00  0.00           H  
HETATM   39  H   UNL     1       5.128  -1.135  -0.070  1.00  0.00           H  
HETATM   40  H   UNL     1       6.697  -0.320   0.135  1.00  0.00           H  
HETATM   41  H   UNL     1       6.063  -1.368   1.426  1.00  0.00           H  
HETATM   42  H   UNL     1       5.521   2.076   2.729  1.00  0.00           H  
HETATM   43  H   UNL     1       6.292   0.507   3.061  1.00  0.00           H  
HETATM   44  H   UNL     1       6.926   1.555   1.769  1.00  0.00           H  
CONECT    1    2   21   21   26                                       
CONECT    2    3    3    1   27                                       
CONECT    3    2    2    5   28                                       
CONECT    4   18   15   16                                            
CONECT    5    3    8    6    6                                       
CONECT    6    5    5   21   29                                       
CONECT    7   19   13   13                                            
CONECT    8    9    9    5   19                                       
CONECT    9    8    8   20   30                                       
CONECT   10   20   19   19   11                                       
CONECT   11   10   12   12   31                                       
CONECT   12   11   11   13   32                                       
CONECT   13    7    7   12   14                                       
CONECT   14   13   18   18   17                                       
CONECT   15    4   33   34   35                                       
CONECT   16    4   17   17                                            
CONECT   17   14   16   16   36                                       
CONECT   18   14   14    4   37                                       
CONECT   19    8   10   10    7                                       
CONECT   20    9   10                                                 
CONECT   21    1    1    6   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   25   24   38                                       
CONECT   24   23   39   40   41                                       
CONECT   25   23   42   43   44                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    6                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
