COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.522   4.220   1.146  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.099   3.277   0.228  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.089   2.648  -0.718  1.00  0.00           C  
HETATM    4  C   UNL     1       3.050   1.969  -1.038  1.00  0.00           C  
HETATM    5  C   UNL     1       3.718   0.783  -0.338  1.00  0.00           C  
HETATM    6  C   UNL     1       5.835  -0.526  -0.127  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.619   4.665  -0.537  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.264   0.938  -0.178  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.441   0.322  -1.124  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.729  -1.196   0.821  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.715  -3.280  -0.095  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.761   5.188  -1.410  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.438  -4.062   0.805  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.626  -5.250  -0.931  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.254  -5.427   0.834  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.559   2.873   0.007  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.460   2.402  -0.210  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.264  -1.043  -1.096  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.906  -1.811  -0.124  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.806  -3.884  -0.964  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.348  -6.025  -0.033  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.168  -7.371  -0.002  1.00  0.00           O  
HETATM   23  C   UNL     1      -2.943  -8.108   0.945  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.907   0.168   0.795  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.420   3.215  -0.481  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.882   5.231   0.115  1.00  0.00           C  
HETATM   27  C   UNL     1       0.386   4.801   2.010  1.00  0.00           C  
HETATM   28  C   UNL     1       1.721   4.442   1.958  1.00  0.00           C  
HETATM   29  C   UNL     1       2.149   3.501   1.043  1.00  0.00           C  
HETATM   30  C   UNL     1       1.237   2.911   0.178  1.00  0.00           C  
HETATM   31  O   UNL     1       1.656   1.984  -0.723  1.00  0.00           O  
HETATM   32  C   UNL     1       5.196   0.726  -0.730  1.00  0.00           C  
HETATM   33  C   UNL     1       7.337  -0.523  -0.420  1.00  0.00           C  
HETATM   34  C   UNL     1       7.947  -1.810   0.072  1.00  0.00           C  
HETATM   35  O   UNL     1       9.276  -1.988   0.014  1.00  0.00           O  
HETATM   36  O   UNL     1       7.240  -2.683   0.517  1.00  0.00           O  
HETATM   37  H   UNL     1      -1.563   4.505   1.185  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.788   2.848  -1.746  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.118   1.571  -0.551  1.00  0.00           H  
HETATM   40  H   UNL     1       3.509   2.897  -0.699  1.00  0.00           H  
HETATM   41  H   UNL     1       3.178   1.873  -2.116  1.00  0.00           H  
HETATM   42  H   UNL     1       3.633   0.904   0.742  1.00  0.00           H  
HETATM   43  H   UNL     1       3.226  -0.141  -0.640  1.00  0.00           H  
HETATM   44  H   UNL     1       5.675  -0.532   0.951  1.00  0.00           H  
HETATM   45  H   UNL     1       5.381  -1.414  -0.567  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.711   5.266  -0.482  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.944   0.916  -1.876  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.225  -1.791   1.573  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.606   6.133  -1.929  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.365   4.453  -1.942  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.143  -3.597   1.480  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.922  -5.718  -1.604  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.813  -6.033   1.531  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.628  -1.520  -1.827  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.244  -3.281  -1.663  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.714  -7.759   1.952  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.003  -7.959   0.742  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.703  -9.168   0.865  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.544   0.644   1.527  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.565   4.524   0.586  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.806   6.204   0.599  1.00  0.00           H  
HETATM   62  H   UNL     1       0.054   5.538   2.726  1.00  0.00           H  
HETATM   63  H   UNL     1       2.430   4.902   2.631  1.00  0.00           H  
HETATM   64  H   UNL     1       3.191   3.221   1.003  1.00  0.00           H  
HETATM   65  H   UNL     1       5.282   0.691  -1.816  1.00  0.00           H  
HETATM   66  H   UNL     1       5.706   1.613  -0.354  1.00  0.00           H  
HETATM   67  H   UNL     1       7.498  -0.431  -1.494  1.00  0.00           H  
HETATM   68  H   UNL     1       7.805   0.319   0.091  1.00  0.00           H  
HETATM   69  H   UNL     1       9.621  -2.830   0.341  1.00  0.00           H  
CONECT    1   27   27    2   37                                       
CONECT    2   30   30    1    3                                       
CONECT    3    2   25   38   39                                       
CONECT    4   31    5   40   41                                       
CONECT    5   32    4   42   43                                       
CONECT    6   33   32   44   45                                       
CONECT    7   12   26   25   46                                       
CONECT    8   17    9    9   24                                       
CONECT    9    8    8   18   47                                       
CONECT   10   24   24   19   48                                       
CONECT   11   19   20   20   13                                       
CONECT   12   26    7   49   50                                       
CONECT   13   11   15   15   51                                       
CONECT   14   20   21   21   52                                       
CONECT   15   13   13   21   53                                       
CONECT   16   17   17                                                 
CONECT   17   25   16   16    8                                       
CONECT   18    9   19   19   54                                       
CONECT   19   18   18   10   11                                       
CONECT   20   11   11   14   55                                       
CONECT   21   14   14   15   22                                       
CONECT   22   21   23                                                 
CONECT   23   22   56   57   58                                       
CONECT   24    8   10   10   59                                       
CONECT   25    7    3   17                                            
CONECT   26   12    7   60   61                                       
CONECT   27   28    1    1   62                                       
CONECT   28   29   29   27   63                                       
CONECT   29   28   28   30   64                                       
CONECT   30   29   31    2    2                                       
CONECT   31    4   30                                                 
CONECT   32    6    5   65   66                                       
CONECT   33   34    6   67   68                                       
CONECT   34   36   36   35   33                                       
CONECT   35   34   69                                                 
CONECT   36   34   34                                                 
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   35                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
