COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.784   1.374  -2.230  1.00  0.00           C  
HETATM    2  C   UNL     1       3.490   0.998  -1.903  1.00  0.00           C  
HETATM    3  C   UNL     1       4.009   1.271   0.440  1.00  0.00           C  
HETATM    4  C   UNL     1       3.089   0.942  -0.577  1.00  0.00           C  
HETATM    5  C   UNL     1       0.632   1.373  -0.096  1.00  0.00           C  
HETATM    6  C   UNL     1       1.256  -0.773   0.016  1.00  0.00           C  
HETATM    7  C   UNL     1       0.640   2.870  -0.270  1.00  0.00           C  
HETATM    8  C   UNL     1       2.101  -2.020  -0.027  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.794   1.105   0.472  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.843   0.513  -0.487  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.767   0.413   0.725  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.522   0.365   1.609  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.875   1.440   0.968  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.847  -0.667   0.814  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.015   0.432  -0.123  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.679  -0.855  -0.539  1.00  0.00           C  
HETATM   17  C   UNL     1      -9.044  -0.548  -1.159  1.00  0.00           C  
HETATM   18  C   UNL     1       2.076  -2.701   1.343  1.00  0.00           C  
HETATM   19  C   UNL     1       2.934  -3.967   1.300  1.00  0.00           C  
HETATM   20  C   UNL     1       5.316   1.656   0.094  1.00  0.00           C  
HETATM   21  C   UNL     1       5.692   1.698  -1.247  1.00  0.00           C  
HETATM   22  C   UNL     1       3.924   1.323   1.850  1.00  0.00           C  
HETATM   23  N   UNL     1       5.075   1.704   2.324  1.00  0.00           N  
HETATM   24  C   UNL     1       2.513   0.647  -2.996  1.00  0.00           C  
HETATM   25  N   UNL     1       5.970   1.923   1.270  1.00  0.00           N  
HETATM   26  C   UNL     1       1.705   0.539  -0.232  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.435   0.615   0.228  1.00  0.00           N  
HETATM   28  N   UNL     1      -0.021  -0.721   0.289  1.00  0.00           N  
HETATM   29  N   UNL     1      -5.796   0.406   0.451  1.00  0.00           N  
HETATM   30  O   UNL     1      -7.577   1.491  -0.305  1.00  0.00           O  
HETATM   31  C   UNL     1       2.377  -4.924   0.244  1.00  0.00           C  
HETATM   32  C   UNL     1       2.402  -4.244  -1.126  1.00  0.00           C  
HETATM   33  C   UNL     1       1.544  -2.978  -1.082  1.00  0.00           C  
HETATM   34  H   UNL     1       5.085   1.409  -3.267  1.00  0.00           H  
HETATM   35  H   UNL     1       0.426   3.116  -1.310  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.120   3.315   0.372  1.00  0.00           H  
HETATM   37  H   UNL     1       1.620   3.262   0.002  1.00  0.00           H  
HETATM   38  H   UNL     1       3.127  -1.755  -0.282  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.843   2.190   0.556  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.190   1.217  -1.244  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.559  -0.453  -0.905  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.148  -0.644   1.784  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.612   0.950   2.524  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.029   1.681   2.020  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.803   2.323   0.333  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.753  -1.447   0.058  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.991  -1.064   1.819  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.054  -1.367  -1.271  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.813  -1.494   0.334  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.669  -0.037  -0.427  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.910   0.091  -2.032  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.524  -1.479  -1.460  1.00  0.00           H  
HETATM   53  H   UNL     1       2.472  -2.019   2.095  1.00  0.00           H  
HETATM   54  H   UNL     1       1.050  -2.966   1.598  1.00  0.00           H  
HETATM   55  H   UNL     1       3.960  -3.702   1.045  1.00  0.00           H  
HETATM   56  H   UNL     1       2.916  -4.452   2.276  1.00  0.00           H  
HETATM   57  H   UNL     1       6.698   1.985  -1.516  1.00  0.00           H  
HETATM   58  H   UNL     1       3.049   1.086   2.438  1.00  0.00           H  
HETATM   59  H   UNL     1       2.576  -0.419  -3.211  1.00  0.00           H  
HETATM   60  H   UNL     1       1.502   0.894  -2.672  1.00  0.00           H  
HETATM   61  H   UNL     1       2.756   1.214  -3.895  1.00  0.00           H  
HETATM   62  H   UNL     1       2.988  -5.826   0.213  1.00  0.00           H  
HETATM   63  H   UNL     1       1.351  -5.189   0.499  1.00  0.00           H  
HETATM   64  H   UNL     1       3.428  -3.979  -1.381  1.00  0.00           H  
HETATM   65  H   UNL     1       2.006  -4.926  -1.878  1.00  0.00           H  
HETATM   66  H   UNL     1       0.518  -3.243  -0.827  1.00  0.00           H  
HETATM   67  H   UNL     1       1.562  -2.493  -2.058  1.00  0.00           H  
HETATM   68  H   UNL     1       6.892   2.212   1.356  1.00  0.00           H  
CONECT    1    2   21   21   34                                       
CONECT    2   24    1    4    4                                       
CONECT    3    4   20   20   22                                       
CONECT    4    2    2   26    3                                       
CONECT    5   26   26   27    7                                       
CONECT    6    8   28   28   26                                       
CONECT    7    5   35   36   37                                       
CONECT    8   18    6   33   38                                       
CONECT    9   12   27   10   39                                       
CONECT   10    9   11   40   41                                       
CONECT   11   12   13   10   14                                       
CONECT   12    9   11   42   43                                       
CONECT   13   11   29   44   45                                       
CONECT   14   11   29   46   47                                       
CONECT   15   30   30   29   16                                       
CONECT   16   15   17   48   49                                       
CONECT   17   16   50   51   52                                       
CONECT   18   19    8   53   54                                       
CONECT   19   18   31   55   56                                       
CONECT   20   21    3    3   25                                       
CONECT   21    1    1   20   57                                       
CONECT   22    3   23   23   58                                       
CONECT   23   22   22   25                                            
CONECT   24    2   59   60   61                                       
CONECT   25   20   23   68                                            
CONECT   26    6    4    5    5                                       
CONECT   27   28    9    5                                            
CONECT   28    6    6   27                                            
CONECT   29   13   15   14                                            
CONECT   30   15   15                                                 
CONECT   31   19   32   62   63                                       
CONECT   32   31   33   64   65                                       
CONECT   33    8   32   66   67                                       
CONECT   34    1                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   24                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   25                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
