COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.905   0.275  -1.399  1.00  0.00           C  
HETATM    2  C   UNL     1       8.198  -1.135  -1.918  1.00  0.00           C  
HETATM    3  O   UNL     1       9.336  -1.663  -1.230  1.00  0.00           O  
HETATM    4  C   UNL     1       9.172  -1.728   0.189  1.00  0.00           C  
HETATM    5  C   UNL     1       8.888  -0.323   0.729  1.00  0.00           C  
HETATM    6  N   UNL     1       7.701   0.224   0.056  1.00  0.00           N  
HETATM    7  C   UNL     1       7.360   1.551   0.586  1.00  0.00           C  
HETATM    8  C   UNL     1       5.907   1.881   0.240  1.00  0.00           C  
HETATM    9  O   UNL     1       5.037   0.974   0.921  1.00  0.00           O  
HETATM   10  C   UNL     1       3.701   1.132   0.720  1.00  0.00           C  
HETATM   11  C   UNL     1       2.801   0.286   1.350  1.00  0.00           C  
HETATM   12  C   UNL     1       1.444   0.445   1.147  1.00  0.00           C  
HETATM   13  C   UNL     1       3.240   2.141  -0.112  1.00  0.00           C  
HETATM   14  C   UNL     1       1.883   2.302  -0.316  1.00  0.00           C  
HETATM   15  C   UNL     1       0.982   1.452   0.310  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.394   1.613   0.102  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.207   0.538   0.104  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.736  -0.580   0.190  1.00  0.00           O  
HETATM   19  N   UNL     1      -2.542   0.702   0.009  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.382  -0.411   0.010  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.995  -1.713   0.101  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.146  -2.506   0.066  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.181  -4.010   0.140  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.911  -4.457   1.579  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.558  -4.511  -0.299  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.109  -4.592  -0.784  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.188  -1.721  -0.041  1.00  0.00           N  
HETATM   28  N   UNL     1      -4.741  -0.394  -0.073  1.00  0.00           N  
HETATM   29  C   UNL     1      -5.548   0.748  -0.176  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.184   1.917   0.478  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.982   3.040   0.375  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.141   3.000  -0.378  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.009   4.227  -0.488  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.505   1.837  -1.030  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.709   0.712  -0.936  1.00  0.00           C  
HETATM   36  H   UNL     1       8.747   0.929  -1.626  1.00  0.00           H  
HETATM   37  H   UNL     1       7.005   0.660  -1.880  1.00  0.00           H  
HETATM   38  H   UNL     1       7.335  -1.776  -1.739  1.00  0.00           H  
HETATM   39  H   UNL     1       8.406  -1.094  -2.987  1.00  0.00           H  
HETATM   40  H   UNL     1       8.336  -2.386   0.429  1.00  0.00           H  
HETATM   41  H   UNL     1      10.083  -2.116   0.643  1.00  0.00           H  
HETATM   42  H   UNL     1       8.705  -0.376   1.802  1.00  0.00           H  
HETATM   43  H   UNL     1       9.746   0.321   0.537  1.00  0.00           H  
HETATM   44  H   UNL     1       7.484   1.552   1.669  1.00  0.00           H  
HETATM   45  H   UNL     1       8.018   2.299   0.144  1.00  0.00           H  
HETATM   46  H   UNL     1       5.682   2.901   0.549  1.00  0.00           H  
HETATM   47  H   UNL     1       5.760   1.786  -0.836  1.00  0.00           H  
HETATM   48  H   UNL     1       3.161  -0.498   2.001  1.00  0.00           H  
HETATM   49  H   UNL     1       0.744  -0.214   1.638  1.00  0.00           H  
HETATM   50  H   UNL     1       3.941   2.803  -0.599  1.00  0.00           H  
HETATM   51  H   UNL     1       1.524   3.088  -0.964  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.762   2.499  -0.042  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.917   1.594  -0.060  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.980  -2.070   0.185  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.675  -4.043   2.237  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.936  -5.545   1.632  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.930  -4.100   1.892  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.751  -4.193  -1.324  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.584  -5.599  -0.246  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.322  -4.097   0.359  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.127  -4.235  -0.471  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.134  -5.680  -0.730  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.301  -4.274  -1.808  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.280   1.949   1.066  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.700   3.951   0.883  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.690   4.822  -1.344  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.048   3.927  -0.622  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.916   4.821   0.421  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.411   1.808  -1.617  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.991  -0.195  -1.449  1.00  0.00           H  
CONECT    1    2    6   36   37                                       
CONECT    2    1    3   38   39                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   40   41                                       
CONECT    5    4    6   42   43                                       
CONECT    6    1    5    7                                            
CONECT    7    6    8   44   45                                       
CONECT    8    7    9   46   47                                       
CONECT    9    8   10                                                 
CONECT   10    9   13   13   11                                       
CONECT   11   10   12   12   48                                       
CONECT   12   11   11   15   49                                       
CONECT   13   10   10   14   50                                       
CONECT   14   13   15   15   51                                       
CONECT   15   12   14   14   16                                       
CONECT   16   15   17   52                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   53                                            
CONECT   20   19   21   21   28                                       
CONECT   21   20   20   22   54                                       
CONECT   22   21   27   27   23                                       
CONECT   23   22   25   24   26                                       
CONECT   24   23   55   56   57                                       
CONECT   25   23   58   59   60                                       
CONECT   26   23   61   62   63                                       
CONECT   27   22   22   28                                            
CONECT   28   20   27   29                                            
CONECT   29   28   30   30   35                                       
CONECT   30   29   29   31   64                                       
CONECT   31   30   32   32   65                                       
CONECT   32   31   31   33   34                                       
CONECT   33   32   66   67   68                                       
CONECT   34   32   35   35   69                                       
CONECT   35   29   34   34   70                                       
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   19                                                      
CONECT   54   21                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   25                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
