COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.173  -3.010  -0.100  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.170  -3.508   0.674  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.881  -2.958   0.580  1.00  0.00           C  
HETATM    4  O   UNL     1      -4.165   3.348  -0.027  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.910   2.823  -0.044  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.668   1.623  -0.676  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.369   1.105  -0.685  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.084  -0.206  -1.371  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.355  -1.342  -0.418  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.644  -1.891  -0.323  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.705  -1.404  -1.106  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.941  -1.961  -0.987  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.820  -3.446   1.362  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.584  -2.889   1.243  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.352  -1.839   0.356  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.353   1.796  -0.067  1.00  0.00           C  
HETATM   17  C   UNL     1       1.018   1.249  -0.077  1.00  0.00           C  
HETATM   18  C   UNL     1       1.653   0.977  -1.293  1.00  0.00           C  
HETATM   19  C   UNL     1       2.933   0.472  -1.302  1.00  0.00           C  
HETATM   20  C   UNL     1       3.598   0.231  -0.098  1.00  0.00           C  
HETATM   21  C   UNL     1       4.974  -0.311  -0.109  1.00  0.00           C  
HETATM   22  N   UNL     1       5.741  -0.600   0.969  1.00  0.00           N  
HETATM   23  N   UNL     1       6.864  -1.054   0.523  1.00  0.00           N  
HETATM   24  N   UNL     1       6.833  -1.061  -0.763  1.00  0.00           N  
HETATM   25  N   UNL     1       5.696  -0.614  -1.172  1.00  0.00           N  
HETATM   26  C   UNL     1       2.964   0.503   1.116  1.00  0.00           C  
HETATM   27  C   UNL     1       1.684   1.008   1.127  1.00  0.00           C  
HETATM   28  N   UNL     1      -0.603   2.989   0.559  1.00  0.00           N  
HETATM   29  C   UNL     1      -1.846   3.506   0.580  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.051   4.573   1.138  1.00  0.00           O  
HETATM   31  H   UNL     1      -6.162  -3.437  -0.028  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.365  -4.321   1.358  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.231   4.194   0.437  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.473   1.088  -1.158  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.725  -0.306  -2.247  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.039  -0.234  -1.681  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.540  -0.591  -1.798  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.754  -1.585  -1.590  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.985  -4.258   2.055  1.00  0.00           H  
HETATM   40  H   UNL     1       0.229  -3.265   1.846  1.00  0.00           H  
HETATM   41  H   UNL     1       0.638  -1.415   0.281  1.00  0.00           H  
HETATM   42  H   UNL     1       1.138   1.163  -2.224  1.00  0.00           H  
HETATM   43  H   UNL     1       3.423   0.262  -2.241  1.00  0.00           H  
HETATM   44  H   UNL     1       5.494  -0.487   1.900  1.00  0.00           H  
HETATM   45  H   UNL     1       3.479   0.316   2.047  1.00  0.00           H  
HETATM   46  H   UNL     1       1.196   1.222   2.067  1.00  0.00           H  
HETATM   47  H   UNL     1       0.123   3.465   0.991  1.00  0.00           H  
CONECT    1    2    2   12   31                                       
CONECT    2    1    1    3   32                                       
CONECT    3    2   13   13   10                                       
CONECT    4    5   33                                                 
CONECT    5    6    6   29    4                                       
CONECT    6    7    5    5   34                                       
CONECT    7    8   16   16    6                                       
CONECT    8    9    7   35   36                                       
CONECT    9   10   10   15    8                                       
CONECT   10    3   11    9    9                                       
CONECT   11   12   12   10   37                                       
CONECT   12    1   11   11   38                                       
CONECT   13    3    3   14   39                                       
CONECT   14   13   15   15   40                                       
CONECT   15   14   14    9   41                                       
CONECT   16   17    7    7   28                                       
CONECT   17   18   18   27   16                                       
CONECT   18   19   17   17   42                                       
CONECT   19   20   20   18   43                                       
CONECT   20   21   19   19   26                                       
CONECT   21   22   25   25   20                                       
CONECT   22   23   21   44                                            
CONECT   23   22   24   24                                            
CONECT   24   23   23   25                                            
CONECT   25   24   21   21                                            
CONECT   26   20   27   27   45                                       
CONECT   27   17   26   26   46                                       
CONECT   28   16   29   47                                            
CONECT   29   28    5   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   22                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
