COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.638   0.470   0.222  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.955   0.324   1.383  1.00  0.00           O  
HETATM    3  C   UNL     1      -0.232   0.160  -0.221  1.00  0.00           C  
HETATM    4  C   UNL     1       0.587  -0.317   0.980  1.00  0.00           C  
HETATM    5  N   UNL     1       1.955  -0.619   0.550  1.00  0.00           N  
HETATM    6  C   UNL     1       2.907   0.339   0.572  1.00  0.00           C  
HETATM    7  C   UNL     1       4.274   0.003   0.133  1.00  0.00           C  
HETATM    8  N   UNL     1       4.552  -1.213  -0.273  1.00  0.00           N  
HETATM    9  C   UNL     1       3.606  -2.169  -0.297  1.00  0.00           C  
HETATM   10  C   UNL     1       3.927  -3.464  -0.735  1.00  0.00           C  
HETATM   11  C   UNL     1       2.968  -4.433  -0.759  1.00  0.00           C  
HETATM   12  C   UNL     1       1.670  -4.155  -0.352  1.00  0.00           C  
HETATM   13  C   UNL     1       1.328  -2.892   0.083  1.00  0.00           C  
HETATM   14  C   UNL     1       2.291  -1.888   0.120  1.00  0.00           C  
HETATM   15  O   UNL     1       2.640   1.465   0.950  1.00  0.00           O  
HETATM   16  C   UNL     1       5.332   1.037   0.150  1.00  0.00           C  
HETATM   17  C   UNL     1       6.665   0.673   0.343  1.00  0.00           C  
HETATM   18  C   UNL     1       7.647   1.642   0.357  1.00  0.00           C  
HETATM   19  C   UNL     1       7.312   2.973   0.181  1.00  0.00           C  
HETATM   20  C   UNL     1       5.992   3.341  -0.011  1.00  0.00           C  
HETATM   21  C   UNL     1       5.001   2.381  -0.034  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.546   0.905  -0.674  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.948   1.237  -0.381  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.655   0.029   0.177  1.00  0.00           C  
HETATM   25  O   UNL     1      -4.053  -1.014   0.320  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.606   1.662  -1.711  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.691   1.004  -2.777  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.297   1.132  -2.109  1.00  0.00           C  
HETATM   29  N   UNL     1      -5.957   0.108   0.518  1.00  0.00           N  
HETATM   30  C   UNL     1      -6.766  -0.988   1.072  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.804   1.309   0.403  1.00  0.00           C  
HETATM   32  C   UNL     1      -8.252   0.766   0.308  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.194  -0.443   1.281  1.00  0.00           C  
HETATM   34  H   UNL     1      -0.254  -0.622  -0.980  1.00  0.00           H  
HETATM   35  H   UNL     1       0.224   1.058  -0.638  1.00  0.00           H  
HETATM   36  H   UNL     1       0.609   0.465   1.739  1.00  0.00           H  
HETATM   37  H   UNL     1       0.132  -1.215   1.397  1.00  0.00           H  
HETATM   38  H   UNL     1       4.934  -3.691  -1.054  1.00  0.00           H  
HETATM   39  H   UNL     1       3.220  -5.427  -1.097  1.00  0.00           H  
HETATM   40  H   UNL     1       0.922  -4.934  -0.377  1.00  0.00           H  
HETATM   41  H   UNL     1       0.316  -2.684   0.398  1.00  0.00           H  
HETATM   42  H   UNL     1       6.928  -0.365   0.481  1.00  0.00           H  
HETATM   43  H   UNL     1       8.679   1.362   0.507  1.00  0.00           H  
HETATM   44  H   UNL     1       8.084   3.728   0.194  1.00  0.00           H  
HETATM   45  H   UNL     1       5.737   4.381  -0.148  1.00  0.00           H  
HETATM   46  H   UNL     1       3.972   2.668  -0.188  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.993   2.057   0.336  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.622   1.272  -1.781  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.601   2.747  -1.815  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.960  -0.041  -2.931  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.725   1.556  -3.716  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.887   2.129  -2.270  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.618   0.375  -2.501  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.786  -1.824   0.372  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.349  -1.311   2.026  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.693   1.938   1.287  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.549   1.869  -0.496  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.971   1.509   0.651  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.481   0.442  -0.708  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.937  -1.194   1.010  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.335  -0.114   2.310  1.00  0.00           H  
CONECT    1    2    2    3   22                                       
CONECT    2    1    1                                                 
CONECT    3    1    4   34   35                                       
CONECT    4    3    5   36   37                                       
CONECT    5    4    6   14                                            
CONECT    6    5    7   15   15                                       
CONECT    7    6    8    8   16                                       
CONECT    8    7    7    9                                            
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   38                                       
CONECT   11   10   12   12   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12   14   14   41                                       
CONECT   14    5    9   13   13                                       
CONECT   15    6    6                                                 
CONECT   16    7   17   17   21                                       
CONECT   17   16   16   18   42                                       
CONECT   18   17   19   19   43                                       
CONECT   19   18   18   20   44                                       
CONECT   20   19   21   21   45                                       
CONECT   21   16   20   20   46                                       
CONECT   22   23   28    1                                            
CONECT   23   22   24   26   47                                       
CONECT   24   23   25   25   29                                       
CONECT   25   24   24                                                 
CONECT   26   23   27   48   49                                       
CONECT   27   26   28   50   51                                       
CONECT   28   22   27   52   53                                       
CONECT   29   30   31   24                                            
CONECT   30   29   33   54   55                                       
CONECT   31   29   32   56   57                                       
CONECT   32   31   33   58   59                                       
CONECT   33   30   32   60   61                                       
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
