COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.392  -4.319  -1.279  1.00  0.00           C  
HETATM    2  C   UNL     1       8.369  -2.891  -0.893  1.00  0.00           C  
HETATM    3  C   UNL     1       7.708  -2.403   0.196  1.00  0.00           C  
HETATM    4  C   UNL     1       8.392  -2.850   1.343  1.00  0.00           C  
HETATM    5  C   UNL     1       6.490  -1.554   0.176  1.00  0.00           C  
HETATM    6  C   UNL     1       5.912  -1.190  -1.039  1.00  0.00           C  
HETATM    7  C   UNL     1       2.981   0.887   0.117  1.00  0.00           C  
HETATM    8  C   UNL     1       0.104   3.978   0.042  1.00  0.00           C  
HETATM    9  C   UNL     1       1.820   5.519  -0.008  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.338   3.677   0.049  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.135   1.509  -0.108  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.595   0.250  -0.251  1.00  0.00           C  
HETATM   13  O   UNL     1      -4.404  -0.836  -0.344  1.00  0.00           O  
HETATM   14  C   UNL     1      -6.556  -1.933  -0.408  1.00  0.00           C  
HETATM   15  C   UNL     1     -10.225  -2.744  -0.648  1.00  0.00           C  
HETATM   16  C   UNL     1     -10.949  -3.497   0.487  1.00  0.00           C  
HETATM   17  C   UNL     1      -9.908  -4.564   0.918  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.578  -3.791   0.743  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.195   0.099  -0.299  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.395   1.181  -0.210  1.00  0.00           C  
HETATM   21  C   UNL     1       4.785  -0.336   1.346  1.00  0.00           C  
HETATM   22  C   UNL     1       5.917  -1.125   1.370  1.00  0.00           C  
HETATM   23  N   UNL     1       9.415  -3.615  -0.445  1.00  0.00           N  
HETATM   24  N   UNL     1       9.411  -3.570   0.954  1.00  0.00           N  
HETATM   25  C   UNL     1       4.780  -0.401  -1.052  1.00  0.00           C  
HETATM   26  C   UNL     1       4.218   0.027   0.137  1.00  0.00           C  
HETATM   27  N   UNL     1       3.369   2.300   0.081  1.00  0.00           N  
HETATM   28  C   UNL     1       2.395   3.286   0.057  1.00  0.00           C  
HETATM   29  C   UNL     1       1.046   2.945   0.066  1.00  0.00           C  
HETATM   30  N   UNL     1       0.533   5.245   0.005  1.00  0.00           N  
HETATM   31  N   UNL     1       2.737   4.573   0.015  1.00  0.00           N  
HETATM   32  C   UNL     1      -2.368   4.584   0.167  1.00  0.00           C  
HETATM   33  N   UNL     1      -3.517   3.918   0.125  1.00  0.00           N  
HETATM   34  C   UNL     1      -3.276   2.617  -0.014  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.813  -0.601  -0.288  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.064  -1.683  -0.348  1.00  0.00           C  
HETATM   37  N   UNL     1      -8.778  -2.961  -0.463  1.00  0.00           N  
HETATM   38  N   UNL     1      -1.921   2.430  -0.065  1.00  0.00           N  
HETATM   39  H   UNL     1      11.224  -3.652  -1.505  1.00  0.00           H  
HETATM   40  H   UNL     1      10.762  -5.194  -0.745  1.00  0.00           H  
HETATM   41  H   UNL     1       9.917  -4.635  -2.208  1.00  0.00           H  
HETATM   42  H   UNL     1       8.100  -2.731  -1.927  1.00  0.00           H  
HETATM   43  H   UNL     1       8.122  -2.635   2.366  1.00  0.00           H  
HETATM   44  H   UNL     1       6.350  -1.523  -1.968  1.00  0.00           H  
HETATM   45  H   UNL     1       2.389   0.651  -0.767  1.00  0.00           H  
HETATM   46  H   UNL     1       2.390   0.696   1.012  1.00  0.00           H  
HETATM   47  H   UNL     1       2.135   6.552  -0.042  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.206   1.643  -0.070  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.304  -2.406  -1.358  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.264  -2.588   0.412  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.539  -3.139  -1.615  1.00  0.00           H  
HETATM   52  H   UNL     1     -10.450  -1.679  -0.592  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.175  -2.824   1.314  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.857  -3.973   0.116  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.057  -4.857   1.957  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.945  -5.433   0.261  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.389  -3.159   1.611  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.752  -4.487   0.595  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.763  -0.884  -0.410  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.323   1.055  -0.248  1.00  0.00           H  
HETATM   61  H   UNL     1       4.342   0.001   2.272  1.00  0.00           H  
HETATM   62  H   UNL     1       6.359  -1.408   2.315  1.00  0.00           H  
HETATM   63  H   UNL     1       4.331  -0.118  -1.993  1.00  0.00           H  
HETATM   64  H   UNL     1       4.307   2.545   0.074  1.00  0.00           H  
HETATM   65  H   UNL     1       0.736   1.911   0.092  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.260   5.653   0.274  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.065  -0.129   0.662  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.106   0.054  -1.109  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.317  -1.210   0.601  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.357  -1.028  -1.169  1.00  0.00           H  
CONECT    1   23   39   40   41                                       
CONECT    2   23    3    3   42                                       
CONECT    3    4    2    2    5                                       
CONECT    4   24   24    3   43                                       
CONECT    5    3   22   22    6                                       
CONECT    6    5   25   25   44                                       
CONECT    7   26   27   45   46                                       
CONECT    8   10   30   30   29                                       
CONECT    9   30   31   31   47                                       
CONECT   10   32   32   38    8                                       
CONECT   11   34   12   12   48                                       
CONECT   12   11   11   13   19                                       
CONECT   13   35   12                                                 
CONECT   14   35   36   49   50                                       
CONECT   15   16   37   51   52                                       
CONECT   16   15   17   53   54                                       
CONECT   17   16   18   55   56                                       
CONECT   18   37   17   57   58                                       
CONECT   19   12   20   20   59                                       
CONECT   20   38   19   19   60                                       
CONECT   21   22   26   26   61                                       
CONECT   22    5    5   21   62                                       
CONECT   23   24    1    2                                            
CONECT   24   23    4    4                                            
CONECT   25    6    6   26   63                                       
CONECT   26   21   21   25    7                                       
CONECT   27   28    7   64                                            
CONECT   28   29   29   31   27                                       
CONECT   29    8   28   28   65                                       
CONECT   30    8    8    9                                            
CONECT   31    9    9   28                                            
CONECT   32   33   10   10   66                                       
CONECT   33   32   34   34                                            
CONECT   34   33   33   11   38                                       
CONECT   35   14   13   67   68                                       
CONECT   36   14   37   69   70                                       
CONECT   37   15   18   36                                            
CONECT   38   34   10   20                                            
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   22                                                      
CONECT   63   25                                                      
CONECT   64   27                                                      
CONECT   65   29                                                      
CONECT   66   32                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
