COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.338   2.780  -0.866  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.730  -1.271  -0.339  1.00  0.00           C  
HETATM    3  O   UNL     1      -5.524  -0.771   0.243  1.00  0.00           O  
HETATM    4  C   UNL     1       4.247   2.038   0.378  1.00  0.00           C  
HETATM    5  C   UNL     1       0.951   2.340  -1.337  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.325   0.933   1.467  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.096   1.560   0.845  1.00  0.00           C  
HETATM    8  C   UNL     1       5.631  -2.540  -0.087  1.00  0.00           C  
HETATM    9  C   UNL     1       5.481  -1.437   0.928  1.00  0.00           C  
HETATM   10  O   UNL     1       4.973  -0.266   0.288  1.00  0.00           O  
HETATM   11  C   UNL     1       4.793   0.846   1.168  1.00  0.00           C  
HETATM   12  O   UNL     1       2.941   1.728  -0.111  1.00  0.00           O  
HETATM   13  N   UNL     1       0.079   2.148  -0.176  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.199   1.758  -0.350  1.00  0.00           C  
HETATM   15  O   UNL     1      -3.392   1.149   0.406  1.00  0.00           O  
HETATM   16  C   UNL     1      -5.670   0.498   0.882  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.457  -2.628  -0.992  1.00  0.00           C  
HETATM   18  N   UNL     1      -6.092  -3.604   0.043  1.00  0.00           N  
HETATM   19  O   UNL     1      -1.628   1.565  -1.468  1.00  0.00           O  
HETATM   20  O   UNL     1       5.333  -2.343  -1.242  1.00  0.00           O  
HETATM   21  H   UNL     1       2.960   3.009  -1.732  1.00  0.00           H  
HETATM   22  H   UNL     1       2.245   3.668  -0.241  1.00  0.00           H  
HETATM   23  H   UNL     1      -7.487  -1.386   0.436  1.00  0.00           H  
HETATM   24  H   UNL     1      -7.087  -0.570  -1.094  1.00  0.00           H  
HETATM   25  H   UNL     1       4.194   2.911   1.029  1.00  0.00           H  
HETATM   26  H   UNL     1       4.909   2.251  -0.461  1.00  0.00           H  
HETATM   27  H   UNL     1       0.527   3.106  -1.987  1.00  0.00           H  
HETATM   28  H   UNL     1       1.034   1.403  -1.888  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.947   0.154   2.129  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.454   1.857   2.030  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.673   0.794   1.495  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.180   2.497   1.396  1.00  0.00           H  
HETATM   33  H   UNL     1       4.790  -1.754   1.709  1.00  0.00           H  
HETATM   34  H   UNL     1       6.453  -1.217   1.371  1.00  0.00           H  
HETATM   35  H   UNL     1       5.750   1.114   1.615  1.00  0.00           H  
HETATM   36  H   UNL     1       4.087   0.577   1.953  1.00  0.00           H  
HETATM   37  H   UNL     1       0.421   2.302   0.719  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.005   1.236   0.153  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.406   0.420   1.683  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.353  -2.967  -1.512  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.639  -2.530  -1.704  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.907  -4.509  -0.363  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.302  -3.281   0.582  1.00  0.00           H  
HETATM   44  O   UNL     1       6.096  -3.742   0.290  1.00  0.00           O  
HETATM   45  H   UNL     1       6.174  -4.418  -0.397  1.00  0.00           H  
CONECT    1    5   12   21   22                                       
CONECT    2   17    3   23   24                                       
CONECT    3    2   16                                                 
CONECT    4   12   11   25   26                                       
CONECT    5   13    1   27   28                                       
CONECT    6   16   15   29   30                                       
CONECT    7   15   14   31   32                                       
CONECT    8   20   20    9   44                                       
CONECT    9   10    8   33   34                                       
CONECT   10   11    9                                                 
CONECT   11   10    4   35   36                                       
CONECT   12    1    4                                                 
CONECT   13   14    5   37                                            
CONECT   14    7   13   19   19                                       
CONECT   15    7    6                                                 
CONECT   16    3    6   38   39                                       
CONECT   17    2   18   40   41                                       
CONECT   18   17   42   43                                            
CONECT   19   14   14                                                 
CONECT   20    8    8                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    2                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44    8   45                                                 
CONECT   45   44                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
