COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.594   0.162   0.259  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.245   0.087  -0.916  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.304  -0.938  -0.803  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.220  -1.436   0.513  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.097  -2.422   0.934  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.052  -2.912   0.057  1.00  0.00           C  
HETATM    7  C   UNL     1      -9.135  -2.424  -1.233  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.264  -1.437  -1.668  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.109  -0.700   1.153  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.726  -0.849   2.296  1.00  0.00           O  
HETATM   11  O   UNL     1      -6.003   0.750  -1.905  1.00  0.00           O  
HETATM   12  C   UNL     1      -4.475   1.068   0.530  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.158   0.371   0.182  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.990   1.317   0.465  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.669   0.579   0.236  1.00  0.00           C  
HETATM   16  C   UNL     1       0.479   1.470   0.632  1.00  0.00           C  
HETATM   17  O   UNL     1       0.263   2.586   1.056  1.00  0.00           O  
HETATM   18  C   UNL     1       1.862   0.988   0.505  1.00  0.00           C  
HETATM   19  C   UNL     1       2.930   1.815   0.873  1.00  0.00           C  
HETATM   20  C   UNL     1       4.214   1.365   0.754  1.00  0.00           C  
HETATM   21  C   UNL     1       4.461   0.080   0.268  1.00  0.00           C  
HETATM   22  C   UNL     1       3.398  -0.745  -0.105  1.00  0.00           C  
HETATM   23  C   UNL     1       2.112  -0.300   0.017  1.00  0.00           C  
HETATM   24  C   UNL     1       5.855  -0.407   0.140  1.00  0.00           C  
HETATM   25  C   UNL     1       6.167  -1.726   0.472  1.00  0.00           C  
HETATM   26  C   UNL     1       7.465  -2.176   0.352  1.00  0.00           C  
HETATM   27  C   UNL     1       8.460  -1.318  -0.098  1.00  0.00           C  
HETATM   28  C   UNL     1       8.153  -0.003  -0.424  1.00  0.00           C  
HETATM   29  C   UNL     1       6.857   0.452  -0.311  1.00  0.00           C  
HETATM   30  O   UNL     1       9.738  -1.764  -0.215  1.00  0.00           O  
HETATM   31  C   UNL     1      10.517  -0.666  -0.694  1.00  0.00           C  
HETATM   32  C   UNL     1      11.975  -1.104  -0.848  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.069   2.504  -0.460  1.00  0.00           C  
HETATM   34  O   UNL     1      -3.147   3.303  -0.436  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.162   2.736  -1.224  1.00  0.00           O  
HETATM   36  H   UNL     1      -8.037  -2.808   1.941  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.736  -3.681   0.384  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.883  -2.814  -1.907  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.333  -1.059  -2.678  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.475   1.339   1.585  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.581   1.968  -0.076  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.159   0.100  -0.874  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.053  -0.529   0.788  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.041   1.658   1.499  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.578   0.315  -0.818  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.650  -0.328   0.840  1.00  0.00           H  
HETATM   47  H   UNL     1       2.739   2.809   1.250  1.00  0.00           H  
HETATM   48  H   UNL     1       5.038   2.002   1.038  1.00  0.00           H  
HETATM   49  H   UNL     1       3.592  -1.738  -0.482  1.00  0.00           H  
HETATM   50  H   UNL     1       1.290  -0.940  -0.267  1.00  0.00           H  
HETATM   51  H   UNL     1       5.394  -2.393   0.821  1.00  0.00           H  
HETATM   52  H   UNL     1       7.708  -3.196   0.608  1.00  0.00           H  
HETATM   53  H   UNL     1       8.930   0.661  -0.773  1.00  0.00           H  
HETATM   54  H   UNL     1       6.618   1.473  -0.568  1.00  0.00           H  
HETATM   55  H   UNL     1      10.458   0.158   0.017  1.00  0.00           H  
HETATM   56  H   UNL     1      10.131  -0.341  -1.660  1.00  0.00           H  
HETATM   57  H   UNL     1      12.569  -0.267  -1.214  1.00  0.00           H  
HETATM   58  H   UNL     1      12.361  -1.429   0.118  1.00  0.00           H  
HETATM   59  H   UNL     1      12.033  -1.929  -1.559  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.198   4.065  -1.029  1.00  0.00           H  
CONECT    1    2    9   12                                            
CONECT    2    1    3   11   11                                       
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5    9                                       
CONECT    5    4    6    6   36                                       
CONECT    6    5    5    7   37                                       
CONECT    7    6    8    8   38                                       
CONECT    8    3    7    7   39                                       
CONECT    9    1    4   10   10                                       
CONECT   10    9    9                                                 
CONECT   11    2    2                                                 
CONECT   12    1   13   40   41                                       
CONECT   13   12   14   42   43                                       
CONECT   14   13   15   33   44                                       
CONECT   15   14   16   45   46                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   23   23                                       
CONECT   19   18   20   20   47                                       
CONECT   20   19   19   21   48                                       
CONECT   21   20   22   22   24                                       
CONECT   22   21   21   23   49                                       
CONECT   23   18   18   22   50                                       
CONECT   24   21   25   29   29                                       
CONECT   25   24   26   26   51                                       
CONECT   26   25   25   27   52                                       
CONECT   27   26   28   28   30                                       
CONECT   28   27   27   29   53                                       
CONECT   29   24   24   28   54                                       
CONECT   30   27   31                                                 
CONECT   31   30   32   55   56                                       
CONECT   32   31   57   58   59                                       
CONECT   33   14   34   35   35                                       
CONECT   34   33   60                                                 
CONECT   35   33   33                                                 
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   34                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
