COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.911   0.886  -0.807  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.757   0.705  -0.464  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.997   1.770   0.078  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.607   3.138   0.239  1.00  0.00           C  
HETATM    5  N   UNL     1      -6.192  -0.512  -0.593  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.916  -0.712  -0.214  1.00  0.00           C  
HETATM    7  O   UNL     1      -4.420  -1.815  -0.336  1.00  0.00           O  
HETATM    8  N   UNL     1      -4.182   0.293   0.298  1.00  0.00           N  
HETATM    9  C   UNL     1      -4.720   1.542   0.451  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.796   0.046   0.702  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.988  -0.428  -0.508  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.603  -0.696  -0.099  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.543  -1.764   0.907  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.308  -1.330   2.159  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.764  -1.036   1.786  1.00  0.00           C  
HETATM   16  C   UNL     1       0.236  -1.020  -1.261  1.00  0.00           C  
HETATM   17  C   UNL     1       1.684  -1.047  -0.844  1.00  0.00           C  
HETATM   18  C   UNL     1       2.252  -2.225  -0.396  1.00  0.00           C  
HETATM   19  C   UNL     1       3.580  -2.253  -0.013  1.00  0.00           C  
HETATM   20  C   UNL     1       4.343  -1.104  -0.076  1.00  0.00           C  
HETATM   21  C   UNL     1       3.775   0.081  -0.525  1.00  0.00           C  
HETATM   22  C   UNL     1       2.444   0.105  -0.914  1.00  0.00           C  
HETATM   23  O   UNL     1       4.523   1.213  -0.588  1.00  0.00           O  
HETATM   24  C   UNL     1       5.827   1.138  -0.213  1.00  0.00           C  
HETATM   25  C   UNL     1       6.804   0.832  -1.150  1.00  0.00           C  
HETATM   26  C   UNL     1       8.128   0.756  -0.766  1.00  0.00           C  
HETATM   27  C   UNL     1       8.481   0.985   0.551  1.00  0.00           C  
HETATM   28  C   UNL     1       7.510   1.290   1.487  1.00  0.00           C  
HETATM   29  C   UNL     1       6.185   1.373   1.107  1.00  0.00           C  
HETATM   30  H   UNL     1      -7.638   3.121  -0.115  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.589   3.423   1.291  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.035   3.861  -0.343  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.707  -1.248  -0.961  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.125   2.342   0.867  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.361   0.966   1.092  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.432  -1.340  -0.907  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.996   0.345  -1.276  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.994  -2.670   0.502  1.00  0.00           H  
HETATM   39  H   UNL     1       0.497  -1.961   1.166  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.277  -2.130   2.900  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.849  -0.433   2.573  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.302  -0.684   2.667  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.234  -1.944   1.408  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.048  -1.997  -1.653  1.00  0.00           H  
HETATM   45  H   UNL     1       0.094  -0.264  -2.033  1.00  0.00           H  
HETATM   46  H   UNL     1       1.657  -3.125  -0.346  1.00  0.00           H  
HETATM   47  H   UNL     1       4.021  -3.175   0.336  1.00  0.00           H  
HETATM   48  H   UNL     1       5.380  -1.126   0.223  1.00  0.00           H  
HETATM   49  H   UNL     1       1.999   1.025  -1.264  1.00  0.00           H  
HETATM   50  H   UNL     1       6.528   0.653  -2.179  1.00  0.00           H  
HETATM   51  H   UNL     1       8.889   0.518  -1.495  1.00  0.00           H  
HETATM   52  H   UNL     1       9.518   0.926   0.850  1.00  0.00           H  
HETATM   53  H   UNL     1       7.789   1.468   2.516  1.00  0.00           H  
HETATM   54  H   UNL     1       5.427   1.611   1.838  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    5    3                                       
CONECT    3    2    4    9    9                                       
CONECT    4    3   30   31   32                                       
CONECT    5    2    6   33                                            
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9   10                                            
CONECT    9    3    3    8   34                                       
CONECT   10    8   11   15   35                                       
CONECT   11   10   12   36   37                                       
CONECT   12   11   16   13                                            
CONECT   13   12   14   38   39                                       
CONECT   14   15   13   40   41                                       
CONECT   15   10   14   42   43                                       
CONECT   16   17   12   44   45                                       
CONECT   17   18   18   22   16                                       
CONECT   18   19   17   17   46                                       
CONECT   19   20   20   18   47                                       
CONECT   20   19   19   21   48                                       
CONECT   21   20   23   22   22                                       
CONECT   22   21   21   17   49                                       
CONECT   23   24   21                                                 
CONECT   24   25   25   29   23                                       
CONECT   25   26   24   24   50                                       
CONECT   26   27   27   25   51                                       
CONECT   27   26   26   28   52                                       
CONECT   28   27   29   29   53                                       
CONECT   29   28   28   24   54                                       
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
