COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.112   2.897  -1.112  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.095  -2.606  -0.276  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.135  -3.984  -0.241  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.971  -4.712  -0.057  1.00  0.00           C  
HETATM    5  C   UNL     1       0.735   1.414   2.075  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.058   0.278  -0.339  1.00  0.00           C  
HETATM    7  C   UNL     1       5.465   0.543   1.007  1.00  0.00           C  
HETATM    8  C   UNL     1       8.430   0.212  -2.071  1.00  0.00           C  
HETATM    9  C   UNL     1       9.147  -0.477  -3.234  1.00  0.00           C  
HETATM   10  C   UNL     1       9.972  -0.677  -0.462  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.211   1.906  -0.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.446   0.737   0.202  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.009   0.796   0.544  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.602   1.359   1.756  1.00  0.00           C  
HETATM   15  C   UNL     1       1.687   0.906   1.187  1.00  0.00           C  
HETATM   16  C   UNL     1       3.123   0.970   1.527  1.00  0.00           C  
HETATM   17  O   UNL     1       3.477   1.464   2.579  1.00  0.00           O  
HETATM   18  N   UNL     1       4.040   0.480   0.669  1.00  0.00           N  
HETATM   19  C   UNL     1       6.285  -0.076  -0.127  1.00  0.00           C  
HETATM   20  C   UNL     1       7.772  -0.010   0.225  1.00  0.00           C  
HETATM   21  N   UNL     1       8.559  -0.610  -0.861  1.00  0.00           N1+
HETATM   22  C   UNL     1      10.123  -1.631   0.724  1.00  0.00           C  
HETATM   23  C   UNL     1       1.280   0.338  -0.023  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.096  -0.494   0.090  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.493  -0.512  -0.112  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.883  -1.937  -0.123  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.703  -2.677   0.059  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.644  -1.794   0.178  1.00  0.00           N  
HETATM   29  C   UNL     1      -3.762  -4.067   0.093  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.504  -4.873   0.293  1.00  0.00           C  
HETATM   31  N   UNL     1      -5.168   0.617  -0.272  1.00  0.00           N1+
HETATM   32  C   UNL     1      -6.619   0.558  -0.068  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.554   1.777  -0.485  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.247   2.809  -2.103  1.00  0.00           C  
HETATM   35  C   UNL     1      -4.570   4.133  -0.892  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.388   4.282  -0.176  1.00  0.00           C  
HETATM   37  C   UNL     1      -2.705   3.184   0.257  1.00  0.00           C  
HETATM   38  H   UNL     1      -7.012  -2.057  -0.428  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.079  -4.496  -0.358  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.010  -5.791  -0.030  1.00  0.00           H  
HETATM   41  H   UNL     1       1.050   1.853   3.011  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.373  -0.161  -1.274  1.00  0.00           H  
HETATM   43  H   UNL     1       5.760   1.583   1.143  1.00  0.00           H  
HETATM   44  H   UNL     1       5.645  -0.010   1.929  1.00  0.00           H  
HETATM   45  H   UNL     1       8.879   1.189  -1.896  1.00  0.00           H  
HETATM   46  H   UNL     1       7.375   0.335  -2.316  1.00  0.00           H  
HETATM   47  H   UNL     1       9.051   0.133  -4.133  1.00  0.00           H  
HETATM   48  H   UNL     1      10.202  -0.600  -2.990  1.00  0.00           H  
HETATM   49  H   UNL     1       8.698  -1.455  -3.409  1.00  0.00           H  
HETATM   50  H   UNL     1      10.569  -1.040  -1.299  1.00  0.00           H  
HETATM   51  H   UNL     1      10.316   0.317  -0.175  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.338   1.752   2.443  1.00  0.00           H  
HETATM   53  H   UNL     1       3.758   0.086  -0.171  1.00  0.00           H  
HETATM   54  H   UNL     1       5.989  -1.116  -0.263  1.00  0.00           H  
HETATM   55  H   UNL     1       6.105   0.476  -1.049  1.00  0.00           H  
HETATM   56  H   UNL     1       8.069   1.030   0.357  1.00  0.00           H  
HETATM   57  H   UNL     1       7.951  -0.559   1.150  1.00  0.00           H  
HETATM   58  H   UNL     1       9.652  -2.585   0.485  1.00  0.00           H  
HETATM   59  H   UNL     1      11.181  -1.790   0.930  1.00  0.00           H  
HETATM   60  H   UNL     1       9.643  -1.199   1.602  1.00  0.00           H  
HETATM   61  H   UNL     1       2.014  -0.062  -0.706  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.717  -2.054   0.304  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.059  -5.098  -0.677  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.797  -4.301   0.893  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.746  -5.804   0.806  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.852   0.818   0.964  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.109   1.263  -0.740  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.975  -0.451  -0.278  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.197   2.880  -1.574  1.00  0.00           H  
HETATM   70  H   UNL     1      -6.167   3.627  -2.820  1.00  0.00           H  
HETATM   71  H   UNL     1      -6.195   1.857  -2.631  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.074   5.003  -1.284  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.007   5.268   0.039  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.787   3.320   0.809  1.00  0.00           H  
HETATM   75  H   UNL     1       8.219  -1.541  -1.048  1.00  0.00           H  
CONECT    1   34   33   33   35                                       
CONECT    2    3    3   26   38                                       
CONECT    3    2    2    4   39                                       
CONECT    4    3   29   29   40                                       
CONECT    5   14   15   15   41                                       
CONECT    6   13   23   23   42                                       
CONECT    7   18   19   43   44                                       
CONECT    8   21    9   45   46                                       
CONECT    9    8   47   48   49                                       
CONECT   10   21   22   50   51                                       
CONECT   11   33   12   37   37                                       
CONECT   12   24   24   11   13                                       
CONECT   13   12   14   14    6                                       
CONECT   14   13   13    5   52                                       
CONECT   15    5    5   23   16                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16    7   53                                            
CONECT   19    7   20   54   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21   20    8   10   75                                       
CONECT   22   10   58   59   60                                       
CONECT   23    6    6   15   61                                       
CONECT   24   25   28   12   12                                       
CONECT   25   26   31   31   24                                       
CONECT   26    2   25   27   27                                       
CONECT   27   26   26   29   28                                       
CONECT   28   27   24   62                                            
CONECT   29    4    4   27   30                                       
CONECT   30   29   63   64   65                                       
CONECT   31   32   25   25   33                                       
CONECT   32   31   66   67   68                                       
CONECT   33   31    1    1   11                                       
CONECT   34    1   69   70   71                                       
CONECT   35    1   36   36   72                                       
CONECT   36   35   35   37   73                                       
CONECT   37   11   11   36   74                                       
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48    9                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   14                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   28                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   34                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   37                                                      
CONECT   75   21                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
