COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.854  -0.903   0.515  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.227  -1.105   0.176  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.546  -0.357  -1.121  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.223   1.129  -0.937  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.754   1.274  -0.529  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.504   0.463   0.745  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.048   0.553   1.120  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.461   2.651  -0.284  1.00  0.00           O  
HETATM    9  O   UNL     1      -5.449   1.823  -2.166  1.00  0.00           O  
HETATM   10  O   UNL     1      -6.933  -0.511  -1.433  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.490  -2.600  -0.019  1.00  0.00           C  
HETATM   12  O   UNL     1      -5.304  -3.282   1.223  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.038   0.250   0.348  1.00  0.00           N  
HETATM   14  C   UNL     1       0.112   0.449   1.006  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.164   0.886   2.216  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.563   0.964   2.306  1.00  0.00           N  
HETATM   17  C   UNL     1       1.472   0.216   0.460  1.00  0.00           C  
HETATM   18  C   UNL     1       1.623  -0.249  -0.856  1.00  0.00           C  
HETATM   19  C   UNL     1       2.856  -0.470  -1.379  1.00  0.00           C  
HETATM   20  C   UNL     1       4.004  -0.234  -0.599  1.00  0.00           C  
HETATM   21  C   UNL     1       3.862   0.236   0.733  1.00  0.00           C  
HETATM   22  C   UNL     1       2.579   0.463   1.250  1.00  0.00           C  
HETATM   23  C   UNL     1       5.287  -0.457  -1.118  1.00  0.00           C  
HETATM   24  C   UNL     1       6.397  -0.214  -0.324  1.00  0.00           C  
HETATM   25  C   UNL     1       6.243   0.251   0.995  1.00  0.00           C  
HETATM   26  C   UNL     1       5.009   0.473   1.515  1.00  0.00           C  
HETATM   27  C   UNL     1       7.750  -0.447  -0.866  1.00  0.00           C  
HETATM   28  O   UNL     1       8.832  -0.213  -0.098  1.00  0.00           O  
HETATM   29  O   UNL     1       7.888  -0.850  -2.004  1.00  0.00           O  
HETATM   30  H   UNL     1      -5.859  -0.726   0.979  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.944  -0.763  -1.934  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.861   1.547  -0.159  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.115   0.901  -1.329  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.114   0.863   1.556  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.602   3.225  -1.049  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.264   2.771  -2.122  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.206  -0.062  -2.244  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.514  -2.746  -0.364  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.797  -2.997  -0.760  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.454  -4.236   1.174  1.00  0.00           H  
HETATM   41  H   UNL     1       0.747  -0.432  -1.461  1.00  0.00           H  
HETATM   42  H   UNL     1       2.957  -0.829  -2.393  1.00  0.00           H  
HETATM   43  H   UNL     1       2.456   0.825   2.261  1.00  0.00           H  
HETATM   44  H   UNL     1       5.409  -0.815  -2.130  1.00  0.00           H  
HETATM   45  H   UNL     1       7.118   0.435   1.601  1.00  0.00           H  
HETATM   46  H   UNL     1       4.907   0.831   2.528  1.00  0.00           H  
HETATM   47  H   UNL     1       9.697  -0.380  -0.497  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.079   1.256   3.074  1.00  0.00           H  
CONECT    1    2    6                                                 
CONECT    2    3   11    1   30                                       
CONECT    3   10    4    2   31                                       
CONECT    4    9    3    5   32                                       
CONECT    5    4    8    6   33                                       
CONECT    6    5    1    7   34                                       
CONECT    7    6   16   13   13                                       
CONECT    8    5   35                                                 
CONECT    9    4   36                                                 
CONECT   10    3   37                                                 
CONECT   11   12    2   38   39                                       
CONECT   12   11   40                                                 
CONECT   13    7    7   14                                            
CONECT   14   15   15   13   17                                       
CONECT   15   16   14   14                                            
CONECT   16    7   15   48                                            
CONECT   17   14   22   22   18                                       
CONECT   18   17   19   19   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   21   19   23   23                                       
CONECT   21   22   26   26   20                                       
CONECT   22   17   17   21   43                                       
CONECT   23   20   20   24   44                                       
CONECT   24   25   25   23   27                                       
CONECT   25   26   24   24   45                                       
CONECT   26   21   21   25   46                                       
CONECT   27   24   29   29   28                                       
CONECT   28   27   47                                                 
CONECT   29   27   27                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   28                                                      
CONECT   48   16                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
