COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.057  -0.065   1.289  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.128  -1.091   1.026  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.486  -1.981   2.018  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.468  -2.929   1.784  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.102  -2.998   0.559  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.757  -2.110  -0.450  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.376  -2.172  -1.656  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.766  -1.150  -0.215  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.389  -0.189  -1.272  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.033  -0.091  -2.298  1.00  0.00           O  
HETATM   11  O   UNL     1      -2.293   0.581  -1.048  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.193   1.101   0.309  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.962   2.003   0.416  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.098   3.170  -0.564  1.00  0.00           C  
HETATM   15  C   UNL     1       0.071   4.138  -0.370  1.00  0.00           C  
HETATM   16  C   UNL     1       0.003   5.238  -1.432  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.015   4.768   1.022  1.00  0.00           C  
HETATM   18  N   UNL     1       0.240   1.231   0.092  1.00  0.00           N  
HETATM   19  C   UNL     1       1.438   1.611   0.579  1.00  0.00           C  
HETATM   20  O   UNL     1       1.520   2.593   1.286  1.00  0.00           O  
HETATM   21  C   UNL     1       2.674   0.817   0.246  1.00  0.00           C  
HETATM   22  O   UNL     1       3.823   1.479   0.777  1.00  0.00           O  
HETATM   23  C   UNL     1       2.562  -0.581   0.858  1.00  0.00           C  
HETATM   24  O   UNL     1       1.491  -1.291   0.232  1.00  0.00           O  
HETATM   25  C   UNL     1       3.873  -1.340   0.640  1.00  0.00           C  
HETATM   26  N   UNL     1       3.810  -2.634   1.331  1.00  0.00           N  
HETATM   27  C   UNL     1       4.086  -1.571  -0.857  1.00  0.00           C  
HETATM   28  C   UNL     1       5.433  -2.208  -1.081  1.00  0.00           C  
HETATM   29  O   UNL     1       6.152  -2.453  -0.136  1.00  0.00           O  
HETATM   30  N   UNL     1       5.839  -2.505  -2.331  1.00  0.00           N  
HETATM   31  H   UNL     1      -2.156   0.307   2.309  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.077  -0.528   1.166  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.997  -1.939   2.980  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.741  -3.622   2.567  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.865  -3.742   0.387  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.170  -1.625  -1.718  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.088   1.675   0.548  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.882   2.390   1.432  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.088   2.789  -1.586  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.037   3.692  -0.380  1.00  0.00           H  
HETATM   41  H   UNL     1       1.011   3.597  -0.467  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.938   5.780  -1.335  1.00  0.00           H  
HETATM   43  H   UNL     1       0.836   5.928  -1.294  1.00  0.00           H  
HETATM   44  H   UNL     1       0.064   4.790  -2.424  1.00  0.00           H  
HETATM   45  H   UNL     1       0.033   3.984   1.778  1.00  0.00           H  
HETATM   46  H   UNL     1       0.818   5.458   1.160  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.956   5.309   1.119  1.00  0.00           H  
HETATM   48  H   UNL     1       0.174   0.445  -0.473  1.00  0.00           H  
HETATM   49  H   UNL     1       2.771   0.733  -0.836  1.00  0.00           H  
HETATM   50  H   UNL     1       3.805   1.588   1.738  1.00  0.00           H  
HETATM   51  H   UNL     1       2.365  -0.495   1.926  1.00  0.00           H  
HETATM   52  H   UNL     1       1.600  -1.405  -0.722  1.00  0.00           H  
HETATM   53  H   UNL     1       4.702  -0.755   1.039  1.00  0.00           H  
HETATM   54  H   UNL     1       3.752  -2.508   2.330  1.00  0.00           H  
HETATM   55  H   UNL     1       3.038  -3.189   0.991  1.00  0.00           H  
HETATM   56  H   UNL     1       3.305  -2.229  -1.238  1.00  0.00           H  
HETATM   57  H   UNL     1       4.043  -0.616  -1.382  1.00  0.00           H  
HETATM   58  H   UNL     1       5.263  -2.309  -3.087  1.00  0.00           H  
HETATM   59  H   UNL     1       6.706  -2.915  -2.475  1.00  0.00           H  
CONECT    1    2   12   31   32                                       
CONECT    2    3    8    8    1                                       
CONECT    3    4    4    2   33                                       
CONECT    4    5    3    3   34                                       
CONECT    5    4    6    6   35                                       
CONECT    6    5    5    7    8                                       
CONECT    7    6   36                                                 
CONECT    8    6    2    2    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12                                                 
CONECT   12    1   11   13   37                                       
CONECT   13   12   14   18   38                                       
CONECT   14   15   13   39   40                                       
CONECT   15   16   14   17   41                                       
CONECT   16   15   42   43   44                                       
CONECT   17   15   45   46   47                                       
CONECT   18   13   19   48                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   23   49                                       
CONECT   22   21   50                                                 
CONECT   23   21   24   25   51                                       
CONECT   24   23   52                                                 
CONECT   25   23   27   26   53                                       
CONECT   26   25   54   55                                            
CONECT   27   25   28   56   57                                       
CONECT   28   27   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30   28   58   59                                            
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
