COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.706   1.644  -0.434  1.00  0.00           C  
HETATM    2  C   UNL     1       3.343   2.725  -0.966  1.00  0.00           C  
HETATM    3  C   UNL     1       6.129   0.762   0.218  1.00  0.00           C  
HETATM    4  C   UNL     1       6.194  -0.477   0.864  1.00  0.00           C  
HETATM    5  C   UNL     1       9.822   1.538   0.014  1.00  0.00           C  
HETATM    6  C   UNL     1       7.330   1.424  -0.063  1.00  0.00           C  
HETATM    7  C   UNL     1       8.521   0.836   0.310  1.00  0.00           C  
HETATM    8  C   UNL     1       7.430  -0.994   1.197  1.00  0.00           C  
HETATM    9  C   UNL     1       0.631  -2.451  -0.881  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.710   2.068   0.854  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.291  -5.886  -0.043  1.00  0.00           O  
HETATM   12  C   UNL     1      -8.161   2.525   0.683  1.00  0.00           C  
HETATM   13  C   UNL     1      -8.726   0.423  -0.317  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.298  -0.544   0.055  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.105  -1.267   0.209  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.625   0.044   0.124  1.00  0.00           C  
HETATM   17  O   UNL     1       0.494   2.245  -0.874  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.529   1.092   0.008  1.00  0.00           C  
HETATM   19  O   UNL     1       4.660   2.532  -0.791  1.00  0.00           O  
HETATM   20  C   UNL     1      -5.063   0.709  -0.117  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.280  -0.056  -0.157  1.00  0.00           C  
HETATM   22  C   UNL     1       1.249   1.419  -0.398  1.00  0.00           C  
HETATM   23  C   UNL     1       4.828   1.354  -0.164  1.00  0.00           C  
HETATM   24  N   UNL     1       8.537  -0.332   0.924  1.00  0.00           N  
HETATM   25  N   UNL     1       3.656   0.813   0.049  1.00  0.00           N  
HETATM   26  N   UNL     1       0.754   0.298   0.163  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.202  -2.321   0.333  1.00  0.00           N  
HETATM   28  C   UNL     1      -0.907  -3.596   0.558  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.467  -4.565  -0.559  1.00  0.00           C  
HETATM   30  C   UNL     1       0.890  -3.972  -1.021  1.00  0.00           C  
HETATM   31  N   UNL     1      -2.401  -1.521   0.173  1.00  0.00           N  
HETATM   32  C   UNL     1      -2.883   0.793  -0.029  1.00  0.00           C  
HETATM   33  O   UNL     1      -4.006   1.540  -0.134  1.00  0.00           O  
HETATM   34  N   UNL     1      -4.657  -0.531  -0.006  1.00  0.00           N  
HETATM   35  N   UNL     1      -6.378   1.104  -0.205  1.00  0.00           N  
HETATM   36  O   UNL     1      -9.021   1.382   0.702  1.00  0.00           O  
HETATM   37  H   UNL     1       2.876   3.576  -1.439  1.00  0.00           H  
HETATM   38  H   UNL     1       5.291  -1.020   1.099  1.00  0.00           H  
HETATM   39  H   UNL     1      10.085   2.184   0.851  1.00  0.00           H  
HETATM   40  H   UNL     1      10.608   0.798  -0.136  1.00  0.00           H  
HETATM   41  H   UNL     1       9.712   2.139  -0.889  1.00  0.00           H  
HETATM   42  H   UNL     1       7.325   2.380  -0.565  1.00  0.00           H  
HETATM   43  H   UNL     1       7.490  -1.947   1.701  1.00  0.00           H  
HETATM   44  H   UNL     1       0.094  -2.076  -1.752  1.00  0.00           H  
HETATM   45  H   UNL     1       1.571  -1.914  -0.755  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.047   2.930   0.783  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.590   1.595   1.828  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.014  -6.534  -0.705  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.430   3.195   1.499  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.269   3.046  -0.268  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.850   0.883  -1.297  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.403  -0.426  -0.225  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.186   2.114  -0.059  1.00  0.00           H  
HETATM   54  H   UNL     1      -7.169  -0.563   0.802  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.033  -0.744  -0.964  1.00  0.00           H  
HETATM   56  H   UNL     1       1.351  -0.333   0.594  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.635  -4.004   1.531  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.985  -3.437   0.511  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.189  -4.565  -1.376  1.00  0.00           H  
HETATM   60  H   UNL     1       1.100  -4.238  -2.057  1.00  0.00           H  
HETATM   61  H   UNL     1       1.700  -4.292  -0.366  1.00  0.00           H  
CONECT    1    2    2   25   22                                       
CONECT    2   19    1    1   37                                       
CONECT    3    4    4    6   23                                       
CONECT    4    8    3    3   38                                       
CONECT    5    7   39   40   41                                       
CONECT    6    7    7    3   42                                       
CONECT    7   24    5    6    6                                       
CONECT    8   24   24    4   43                                       
CONECT    9   30   27   44   45                                       
CONECT   10   35   12   46   47                                       
CONECT   11   29   48                                                 
CONECT   12   10   36   49   50                                       
CONECT   13   21   36   51   52                                       
CONECT   14   31   31   32   34                                       
CONECT   15   16   16   27   31                                       
CONECT   16   26   15   15   18                                       
CONECT   17   22   22                                                 
CONECT   18   16   32   32   53                                       
CONECT   19   23    2                                                 
CONECT   20   33   34   34   35                                       
CONECT   21   35   13   54   55                                       
CONECT   22    1   17   17   26                                       
CONECT   23    3   19   25   25                                       
CONECT   24    8    8    7                                            
CONECT   25   23   23    1                                            
CONECT   26   22   16   56                                            
CONECT   27    9   28   15                                            
CONECT   28   29   27   57   58                                       
CONECT   29   30   28   11   59                                       
CONECT   30    9   29   60   61                                       
CONECT   31   15   14   14                                            
CONECT   32   18   18   14   33                                       
CONECT   33   32   20                                                 
CONECT   34   14   20   20                                            
CONECT   35   20   21   10                                            
CONECT   36   13   12                                                 
CONECT   37    2                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   18                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   26                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
