COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.256  -0.645  -0.750  1.00  0.00           C  
HETATM    2  C   UNL     1       3.077   0.373   1.055  1.00  0.00           C  
HETATM    3  C   UNL     1       4.267   0.045   0.458  1.00  0.00           C  
HETATM    4  C   UNL     1       1.882   0.001   0.424  1.00  0.00           C  
HETATM    5  C   UNL     1       0.578   0.339   1.027  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.858   0.311   1.010  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.907  -0.697   0.593  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.843  -2.079   0.517  1.00  0.00           C  
HETATM    9  C   UNL     1       6.699  -0.377  -0.924  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.811   1.938  -0.902  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.364   1.667   0.474  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.892   1.451   0.418  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.075  -0.042   0.253  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.181  -0.773  -0.164  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.113  -2.156  -0.238  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.943  -2.806   0.102  1.00  0.00           C  
HETATM   17  C   UNL     1       6.713  -0.404   0.610  1.00  0.00           C  
HETATM   18  C   UNL     1       5.554   0.448   1.128  1.00  0.00           C  
HETATM   19  C   UNL     1       1.945  -0.693  -0.786  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.564  -0.024   0.411  1.00  0.00           N  
HETATM   21  N   UNL     1       5.445  -0.997  -1.374  1.00  0.00           N  
HETATM   22  N   UNL     1       3.107  -0.986  -1.326  1.00  0.00           N  
HETATM   23  O   UNL     1      -2.469   1.674  -1.880  1.00  0.00           O  
HETATM   24  O   UNL     1      -6.331  -0.132  -0.499  1.00  0.00           O  
HETATM   25  O   UNL     1       0.535   0.944   2.081  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.589   2.475  -1.039  1.00  0.00           O  
HETATM   27  H   UNL     1       3.061   0.911   1.992  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.774   0.342   2.097  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.930  -2.590   0.784  1.00  0.00           H  
HETATM   30  H   UNL     1       6.748   0.653  -1.275  1.00  0.00           H  
HETATM   31  H   UNL     1       7.548  -0.940  -1.311  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.109   2.475   1.159  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.355   1.789   1.345  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.318   1.982  -0.433  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.972  -2.723  -0.562  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.887  -3.883   0.045  1.00  0.00           H  
HETATM   37  H   UNL     1       6.597  -1.430   0.959  1.00  0.00           H  
HETATM   38  H   UNL     1       7.658   0.000   0.974  1.00  0.00           H  
HETATM   39  H   UNL     1       5.756   1.498   0.918  1.00  0.00           H  
HETATM   40  H   UNL     1       5.458   0.310   2.205  1.00  0.00           H  
HETATM   41  H   UNL     1       1.032  -0.985  -1.285  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.529  -0.507  -0.430  1.00  0.00           H  
HETATM   43  H   UNL     1       5.449  -1.643  -2.097  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.387   0.113  -1.433  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.277   2.631  -1.941  1.00  0.00           H  
CONECT    1    3    3   21   22                                       
CONECT    2    4    4    3   27                                       
CONECT    3    2    1    1   18                                       
CONECT    4    2    2    5   19                                       
CONECT    5   20    4   25   25                                       
CONECT    6    7   20   11   28                                       
CONECT    7    8    8    6   13                                       
CONECT    8   16    7    7   29                                       
CONECT    9   21   17   30   31                                       
CONECT   10   23   23   11   26                                       
CONECT   11   12   10    6   32                                       
CONECT   12   11   13   33   34                                       
CONECT   13   12   14   14    7                                       
CONECT   14   13   13   24   15                                       
CONECT   15   14   16   16   35                                       
CONECT   16   15   15    8   36                                       
CONECT   17    9   18   37   38                                       
CONECT   18   17    3   39   40                                       
CONECT   19   22   22    4   41                                       
CONECT   20    6    5   42                                            
CONECT   21    9    1   43                                            
CONECT   22    1   19   19                                            
CONECT   23   10   10                                                 
CONECT   24   14   44                                                 
CONECT   25    5    5                                                 
CONECT   26   10   45                                                 
CONECT   27    2                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   12                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
