COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.052   3.770  -0.056  1.00  0.00           C  
HETATM    2  C   UNL     1       3.207   3.127   1.046  1.00  0.00           C  
HETATM    3  C   UNL     1       2.186   2.209   0.426  1.00  0.00           C  
HETATM    4  O   UNL     1      -6.160  -3.216   0.208  1.00  0.00           O  
HETATM    5  C   UNL     1      -7.057  -2.120   0.012  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.200  -1.840  -1.485  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.426  -2.471   0.599  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.504  -0.878   0.713  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.196  -0.454   0.043  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.643   0.789   0.744  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.334   1.212   0.075  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.782   2.455   0.776  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.493   2.873   0.116  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.294   2.362   0.566  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.516   3.763  -0.943  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.338   4.153  -1.556  1.00  0.00           C  
HETATM   17  C   UNL     1       0.870   3.655  -1.114  1.00  0.00           C  
HETATM   18  C   UNL     1       0.902   2.750  -0.048  1.00  0.00           C  
HETATM   19  C   UNL     1       2.449   0.890   0.304  1.00  0.00           C  
HETATM   20  C   UNL     1       3.683   0.370   0.759  1.00  0.00           C  
HETATM   21  C   UNL     1       3.947  -0.951   0.637  1.00  0.00           C  
HETATM   22  C   UNL     1       2.972  -1.883   0.035  1.00  0.00           C  
HETATM   23  C   UNL     1       1.672  -1.821   0.330  1.00  0.00           C  
HETATM   24  C   UNL     1       3.519  -2.912  -0.933  1.00  0.00           C  
HETATM   25  O   UNL     1       3.871  -2.276  -2.164  1.00  0.00           O  
HETATM   26  C   UNL     1       4.763  -3.550  -0.308  1.00  0.00           C  
HETATM   27  C   UNL     1       5.795  -2.468   0.013  1.00  0.00           C  
HETATM   28  O   UNL     1       7.005  -3.083   0.459  1.00  0.00           O  
HETATM   29  C   UNL     1       5.259  -1.546   1.107  1.00  0.00           C  
HETATM   30  H   UNL     1       4.790   4.434   0.393  1.00  0.00           H  
HETATM   31  H   UNL     1       4.561   2.991  -0.624  1.00  0.00           H  
HETATM   32  H   UNL     1       3.405   4.342  -0.722  1.00  0.00           H  
HETATM   33  H   UNL     1       3.853   2.555   1.712  1.00  0.00           H  
HETATM   34  H   UNL     1       2.698   3.906   1.614  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.448  -4.039  -0.210  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.225  -1.591  -1.903  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.594  -2.726  -1.984  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.884  -1.005  -1.635  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.110  -1.635   0.449  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.819  -3.356   0.100  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.324  -2.670   1.666  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.229  -0.067   0.639  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.319  -1.105   1.763  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.471  -1.265   0.117  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.381  -0.227  -1.006  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.368   1.600   0.671  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.457   0.562   1.794  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.610   0.402   0.148  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.520   1.440  -0.975  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.507   3.266   0.702  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.596   2.228   1.825  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.278   1.664   1.390  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.459   4.157  -1.293  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.364   4.848  -2.381  1.00  0.00           H  
HETATM   55  H   UNL     1       1.789   3.959  -1.593  1.00  0.00           H  
HETATM   56  H   UNL     1       1.717   0.232  -0.141  1.00  0.00           H  
HETATM   57  H   UNL     1       4.415   1.028   1.204  1.00  0.00           H  
HETATM   58  H   UNL     1       1.310  -1.076   1.023  1.00  0.00           H  
HETATM   59  H   UNL     1       0.982  -2.515  -0.126  1.00  0.00           H  
HETATM   60  H   UNL     1       2.767  -3.678  -1.118  1.00  0.00           H  
HETATM   61  H   UNL     1       3.131  -1.836  -2.605  1.00  0.00           H  
HETATM   62  H   UNL     1       4.481  -4.065   0.611  1.00  0.00           H  
HETATM   63  H   UNL     1       5.195  -4.267  -1.006  1.00  0.00           H  
HETATM   64  H   UNL     1       5.996  -1.882  -0.884  1.00  0.00           H  
HETATM   65  H   UNL     1       7.707  -2.456   0.681  1.00  0.00           H  
HETATM   66  H   UNL     1       5.977  -0.748   1.297  1.00  0.00           H  
HETATM   67  H   UNL     1       5.097  -2.120   2.019  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    1    3   33   34                                       
CONECT    3    2   19   19   18                                       
CONECT    4    5   35                                                 
CONECT    5    7    6    8    4                                       
CONECT    6    5   36   37   38                                       
CONECT    7    5   39   40   41                                       
CONECT    8    5    9   42   43                                       
CONECT    9    8   10   44   45                                       
CONECT   10    9   11   46   47                                       
CONECT   11   10   12   48   49                                       
CONECT   12   11   13   50   51                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13   18   52                                       
CONECT   15   13   16   16   53                                       
CONECT   16   15   15   17   54                                       
CONECT   17   18   18   16   55                                       
CONECT   18   14    3   17   17                                       
CONECT   19   20    3    3   56                                       
CONECT   20   21   21   19   57                                       
CONECT   21   29   22   20   20                                       
CONECT   22   23   23   21   24                                       
CONECT   23   22   22   58   59                                       
CONECT   24   22   26   25   60                                       
CONECT   25   24   61                                                 
CONECT   26   27   24   62   63                                       
CONECT   27   29   26   28   64                                       
CONECT   28   27   65                                                 
CONECT   29   21   27   66   67                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
