COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.882  -0.071   0.108  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.518  -1.384  -0.063  1.00  0.00           N  
HETATM    3  C   UNL     1      -3.816  -1.128  -0.324  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.077   0.183  -0.340  1.00  0.00           N  
HETATM    5  C   UNL     1      -3.013   0.909  -0.097  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.304   0.065   1.513  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.146  -0.923   1.682  1.00  0.00           C  
HETATM    8  N   UNL     1       0.878  -0.655   0.664  1.00  0.00           N  
HETATM    9  C   UNL     1       0.347  -0.852  -0.691  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.794   0.138  -0.940  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.652  -1.990  -0.524  1.00  0.00           O  
HETATM   12  N   UNL     1      -2.942   2.257  -0.042  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.905  -2.638   0.026  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.144   3.064  -0.268  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.922   3.198   1.043  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.177   4.040   0.807  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.773   5.429   0.310  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.995   5.295  -1.001  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.740   4.453  -0.765  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.547  -2.731   0.306  1.00  0.00           C  
HETATM   21  C   UNL     1       0.057  -3.970   0.394  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.688  -5.119   0.204  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.042  -5.031  -0.075  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.653  -3.793  -0.159  1.00  0.00           C  
HETATM   25  F   UNL     1      -2.768  -6.156  -0.260  1.00  0.00           F  
HETATM   26  C   UNL     1       2.071  -1.483   0.887  1.00  0.00           C  
HETATM   27  C   UNL     1       3.230  -0.913   0.109  1.00  0.00           C  
HETATM   28  C   UNL     1       3.461  -1.329  -1.189  1.00  0.00           C  
HETATM   29  C   UNL     1       4.520  -0.805  -1.908  1.00  0.00           C  
HETATM   30  C   UNL     1       5.349   0.136  -1.330  1.00  0.00           C  
HETATM   31  C   UNL     1       5.120   0.555  -0.027  1.00  0.00           C  
HETATM   32  C   UNL     1       4.057   0.028   0.691  1.00  0.00           C  
HETATM   33  O   UNL     1       5.935   1.481   0.544  1.00  0.00           O  
HETATM   34  C   UNL     1       6.952   2.047  -0.283  1.00  0.00           C  
HETATM   35  C   UNL     1       8.089   2.575   0.595  1.00  0.00           C  
HETATM   36  C   UNL     1       6.363   3.199  -1.101  1.00  0.00           C  
HETATM   37  N   UNL     1       8.733   1.452   1.289  1.00  0.00           N  
HETATM   38  H   UNL     1      -0.939   1.082   1.660  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.078  -0.154   2.248  1.00  0.00           H  
HETATM   40  H   UNL     1       0.290  -0.806   2.674  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.516  -1.941   1.566  1.00  0.00           H  
HETATM   42  H   UNL     1       1.140  -0.683  -1.420  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.027  -1.871  -0.790  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.210  -0.028  -1.934  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.414   1.157  -0.871  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.095   2.691   0.147  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.772   2.579  -1.015  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.210   2.208   1.397  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.294   3.683   1.790  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.805   3.555   0.060  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.731   4.135   1.741  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.667   6.029   0.141  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.145   5.914   1.057  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.623   4.810  -1.748  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.707   6.285  -1.355  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.112   4.938  -0.018  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.185   4.358  -1.699  1.00  0.00           H  
HETATM   58  H   UNL     1       0.036  -1.834   0.454  1.00  0.00           H  
HETATM   59  H   UNL     1       1.112  -4.041   0.611  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.214  -6.087   0.273  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.709  -3.724  -0.376  1.00  0.00           H  
HETATM   62  H   UNL     1       2.316  -1.490   1.949  1.00  0.00           H  
HETATM   63  H   UNL     1       1.875  -2.501   0.552  1.00  0.00           H  
HETATM   64  H   UNL     1       2.813  -2.065  -1.643  1.00  0.00           H  
HETATM   65  H   UNL     1       4.698  -1.131  -2.922  1.00  0.00           H  
HETATM   66  H   UNL     1       6.177   0.545  -1.891  1.00  0.00           H  
HETATM   67  H   UNL     1       3.873   0.355   1.704  1.00  0.00           H  
HETATM   68  H   UNL     1       7.339   1.284  -0.958  1.00  0.00           H  
HETATM   69  H   UNL     1       8.823   3.086  -0.028  1.00  0.00           H  
HETATM   70  H   UNL     1       7.686   3.273   1.329  1.00  0.00           H  
HETATM   71  H   UNL     1       7.140   3.631  -1.732  1.00  0.00           H  
HETATM   72  H   UNL     1       5.554   2.823  -1.727  1.00  0.00           H  
HETATM   73  H   UNL     1       5.976   3.962  -0.426  1.00  0.00           H  
HETATM   74  H   UNL     1       9.057   0.759   0.632  1.00  0.00           H  
HETATM   75  H   UNL     1       9.487   1.775   1.877  1.00  0.00           H  
CONECT    1    2    5    6   10                                       
CONECT    2    3   13    1                                            
CONECT    3   11   11    4    2                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4    1   12                                       
CONECT    6    1    7   38   39                                       
CONECT    7    6    8   40   41                                       
CONECT    8    7    9   26                                            
CONECT    9   10    8   42   43                                       
CONECT   10    1    9   44   45                                       
CONECT   11    3    3                                                 
CONECT   12    5   14   46                                            
CONECT   13   24   24   20    2                                       
CONECT   14   15   12   19   47                                       
CONECT   15   16   14   48   49                                       
CONECT   16   15   17   50   51                                       
CONECT   17   16   18   52   53                                       
CONECT   18   17   19   54   55                                       
CONECT   19   14   18   56   57                                       
CONECT   20   21   21   13   58                                       
CONECT   21   22   20   20   59                                       
CONECT   22   23   23   21   60                                       
CONECT   23   25   22   22   24                                       
CONECT   24   23   13   13   61                                       
CONECT   25   23                                                      
CONECT   26   27    8   62   63                                       
CONECT   27   28   28   32   26                                       
CONECT   28   29   27   27   64                                       
CONECT   29   30   30   28   65                                       
CONECT   30   29   29   31   66                                       
CONECT   31   30   33   32   32                                       
CONECT   32   31   31   27   67                                       
CONECT   33   31   34                                                 
CONECT   34   33   35   36   68                                       
CONECT   35   37   34   69   70                                       
CONECT   36   34   71   72   73                                       
CONECT   37   35   74   75                                            
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   17                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   30                                                      
CONECT   67   32                                                      
CONECT   68   34                                                      
CONECT   69   35                                                      
CONECT   70   35                                                      
CONECT   71   36                                                      
CONECT   72   36                                                      
CONECT   73   36                                                      
CONECT   74   37                                                      
CONECT   75   37                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
