COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.843   1.497  -0.154  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.243   2.641  -0.680  1.00  0.00           C  
HETATM    3  C   UNL     1       1.130   2.651  -0.843  1.00  0.00           C  
HETATM    4  N   UNL     1       1.830   1.582  -0.498  1.00  0.00           N  
HETATM    5  N   UNL     1      -0.079   0.461   0.170  1.00  0.00           N  
HETATM    6  C   UNL     1       8.564   0.442   0.223  1.00  0.00           C  
HETATM    7  N   UNL     1       7.513  -0.558   0.022  1.00  0.00           N  
HETATM    8  N   UNL     1       7.721  -1.892  -0.345  1.00  0.00           N  
HETATM    9  C   UNL     1       6.580  -2.513  -0.440  1.00  0.00           C  
HETATM   10  C   UNL     1       5.524  -1.558  -0.122  1.00  0.00           C  
HETATM   11  C   UNL     1       4.128  -1.639  -0.059  1.00  0.00           C  
HETATM   12  C   UNL     1       6.166  -0.339   0.169  1.00  0.00           C  
HETATM   13  C   UNL     1       5.406   0.774   0.518  1.00  0.00           C  
HETATM   14  C   UNL     1       4.045   0.681   0.581  1.00  0.00           C  
HETATM   15  C   UNL     1       3.398  -0.518   0.282  1.00  0.00           C  
HETATM   16  N   UNL     1       2.000  -0.591   0.347  1.00  0.00           N  
HETATM   17  C   UNL     1       1.233   0.508  -0.001  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.224   1.445   0.033  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.925   0.396   0.539  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.137   2.467  -0.261  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.336   2.047   0.051  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.613   2.832  -0.105  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.231   0.746   0.557  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.372  -0.113   1.036  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.050  -0.717  -0.119  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.308  -1.369   0.287  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.511  -2.060  -0.404  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.953  -2.523  -0.661  1.00  0.00           C  
HETATM   29  O   UNL     1      -7.252  -3.820  -0.142  1.00  0.00           O  
HETATM   30  H   UNL     1      -0.838   3.500  -0.953  1.00  0.00           H  
HETATM   31  H   UNL     1       1.625   3.521  -1.248  1.00  0.00           H  
HETATM   32  H   UNL     1       8.889   0.423   1.264  1.00  0.00           H  
HETATM   33  H   UNL     1       9.410   0.216  -0.426  1.00  0.00           H  
HETATM   34  H   UNL     1       8.175   1.431  -0.018  1.00  0.00           H  
HETATM   35  H   UNL     1       6.441  -3.550  -0.707  1.00  0.00           H  
HETATM   36  H   UNL     1       3.627  -2.570  -0.276  1.00  0.00           H  
HETATM   37  H   UNL     1       5.893   1.712   0.739  1.00  0.00           H  
HETATM   38  H   UNL     1       3.463   1.549   0.853  1.00  0.00           H  
HETATM   39  H   UNL     1       1.570  -1.411   0.636  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.513  -0.547   0.867  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.036   2.646  -1.092  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.325   2.523   0.660  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.401   3.896   0.005  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.987  -0.900   1.684  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.081   0.501   1.592  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.327  -1.660   1.338  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.200  -0.818  -0.013  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.880  -2.096  -1.292  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.050  -2.536   0.461  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.291  -2.381  -1.688  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.161  -4.109  -0.305  1.00  0.00           H  
CONECT    1   18    5    5    2                                       
CONECT    2    1    3    3   30                                       
CONECT    3    2    2    4   31                                       
CONECT    4   17   17    3                                            
CONECT    5    1    1   17                                            
CONECT    6    7   32   33   34                                       
CONECT    7    8    6   12                                            
CONECT    8    9    9    7                                            
CONECT    9    8    8   10   35                                       
CONECT   10    9   11   12   12                                       
CONECT   11   10   15   15   36                                       
CONECT   12   10   10    7   13                                       
CONECT   13   12   14   14   37                                       
CONECT   14   15   13   13   38                                       
CONECT   15   11   11   16   14                                       
CONECT   16   15   17   39                                            
CONECT   17    5   16    4    4                                       
CONECT   18   19   20    1                                            
CONECT   19   23   23   18   40                                       
CONECT   20   21   21   18                                            
CONECT   21   22   23   20   20                                       
CONECT   22   21   41   42   43                                       
CONECT   23   24   21   19   19                                       
CONECT   24   25   23   44   45                                       
CONECT   25   24   27   26                                            
CONECT   26   25   28   46   47                                       
CONECT   27   25   28   48   49                                       
CONECT   28   27   29   26   50                                       
CONECT   29   28   51                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
