COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.280  -1.329   1.237  1.00  0.00           N  
HETATM    2  C   UNL     1       5.163  -0.123  -1.133  1.00  0.00           C  
HETATM    3  N   UNL     1       2.190  -2.304  -0.923  1.00  0.00           N  
HETATM    4  C   UNL     1       5.237  -2.534  -1.062  1.00  0.00           C  
HETATM    5  N   UNL     1       3.465   4.162   0.024  1.00  0.00           N  
HETATM    6  C   UNL     1       4.523  -1.344  -0.921  1.00  0.00           C  
HETATM    7  C   UNL     1       3.090  -1.377  -0.548  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.017  -2.726   0.259  1.00  0.00           O  
HETATM    9  S   UNL     1      -4.888  -1.442   0.855  1.00  0.00           S  
HETATM   10  O   UNL     1      -5.559  -1.127   2.067  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.152  -0.138  -0.378  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.618  -0.140  -0.816  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.842   0.959  -1.856  1.00  0.00           C  
HETATM   14  N   UNL     1      -8.249   0.957  -2.276  1.00  0.00           N  
HETATM   15  C   UNL     1      -9.131   1.342  -1.166  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.453   1.833  -3.438  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.768  -0.129   1.902  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.656  -0.521   2.876  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.521  -1.201   2.108  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.212   0.837   0.854  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.077   0.157   0.085  1.00  0.00           C  
HETATM   22  C   UNL     1       0.035  -0.235   1.059  1.00  0.00           C  
HETATM   23  N   UNL     1       1.122  -0.886   0.323  1.00  0.00           N  
HETATM   24  C   UNL     1       1.026  -2.016  -0.410  1.00  0.00           C  
HETATM   25  C   UNL     1       6.498  -0.098  -1.479  1.00  0.00           C  
HETATM   26  C   UNL     1       6.575  -2.498  -1.398  1.00  0.00           C  
HETATM   27  C   UNL     1       7.205  -1.283  -1.613  1.00  0.00           C  
HETATM   28  F   UNL     1       8.514  -1.252  -1.942  1.00  0.00           F  
HETATM   29  C   UNL     1       2.429  -0.459   0.251  1.00  0.00           C  
HETATM   30  C   UNL     1       3.007   0.734   0.893  1.00  0.00           C  
HETATM   31  C   UNL     1       3.559   0.668   2.177  1.00  0.00           C  
HETATM   32  C   UNL     1       4.091   1.812   2.741  1.00  0.00           C  
HETATM   33  N   UNL     1       4.077   2.968   2.109  1.00  0.00           N  
HETATM   34  C   UNL     1       3.578   3.096   0.886  1.00  0.00           C  
HETATM   35  C   UNL     1       2.859   3.762  -1.137  1.00  0.00           C  
HETATM   36  C   UNL     1       2.565   2.453  -1.070  1.00  0.00           C  
HETATM   37  C   UNL     1       3.024   1.981   0.234  1.00  0.00           C  
HETATM   38  H   UNL     1      -2.679  -2.060   1.025  1.00  0.00           H  
HETATM   39  H   UNL     1       4.614   0.801  -1.029  1.00  0.00           H  
HETATM   40  H   UNL     1       4.747  -3.482  -0.895  1.00  0.00           H  
HETATM   41  H   UNL     1       3.766   5.064   0.213  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.905   0.830   0.058  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.515  -0.321  -1.243  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.866  -1.108  -1.252  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.256   0.042   0.049  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.594   1.927  -1.420  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.204   0.777  -2.721  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.870   2.343  -0.825  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.167   1.332  -1.505  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.010   0.635  -0.345  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.839   1.484  -4.268  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.503   1.813  -3.728  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.167   2.852  -3.179  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.577   0.356   2.450  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.275   0.373   3.371  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.052  -1.208   3.623  1.00  0.00           H  
HETATM   57  H   UNL     1       0.272  -1.480   2.802  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.902  -2.094   1.613  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.005   1.116   0.160  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.831   1.730   1.349  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.458  -0.737  -0.410  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.681   0.845  -0.661  1.00  0.00           H  
HETATM   63  H   UNL     1       0.416   0.658   1.554  1.00  0.00           H  
HETATM   64  H   UNL     1       0.124  -2.594  -0.549  1.00  0.00           H  
HETATM   65  H   UNL     1       6.994   0.847  -1.648  1.00  0.00           H  
HETATM   66  H   UNL     1       7.128  -3.419  -1.507  1.00  0.00           H  
HETATM   67  H   UNL     1       3.569  -0.265   2.721  1.00  0.00           H  
HETATM   68  H   UNL     1       4.516   1.760   3.733  1.00  0.00           H  
HETATM   69  H   UNL     1       2.649   4.404  -1.980  1.00  0.00           H  
HETATM   70  H   UNL     1       2.084   1.862  -1.835  1.00  0.00           H  
CONECT    1    9   17   38                                            
CONECT    2    6    6   25   39                                       
CONECT    3   24   24    7                                            
CONECT    4   26   26    6   40                                       
CONECT    5   35   34   41                                            
CONECT    6    4    7    2    2                                       
CONECT    7    3    6   29   29                                       
CONECT    8    9    9                                                 
CONECT    9   11    1   10   10                                       
CONECT    9    8    8                                                 
CONECT   10    9    9                                                 
CONECT   11   12    9   42   43                                       
CONECT   12   11   13   44   45                                       
CONECT   13   12   14   46   47                                       
CONECT   14   15   13   16                                            
CONECT   15   14   48   49   50                                       
CONECT   16   14   51   52   53                                       
CONECT   17    1   20   18   54                                       
CONECT   18   17   19   55   56                                       
CONECT   19   22   18   57   58                                       
CONECT   20   21   17   59   60                                       
CONECT   21   20   22   61   62                                       
CONECT   22   21   23   19   63                                       
CONECT   23   24   29   22                                            
CONECT   24    3    3   23   64                                       
CONECT   25   27   27    2   65                                       
CONECT   26    4    4   27   66                                       
CONECT   27   26   28   25   25                                       
CONECT   28   27                                                      
CONECT   29    7    7   23   30                                       
CONECT   30   29   37   37   31                                       
CONECT   31   30   32   32   67                                       
CONECT   32   31   31   33   68                                       
CONECT   33   34   34   32                                            
CONECT   34   37    5   33   33                                       
CONECT   35   36   36    5   69                                       
CONECT   36   35   35   37   70                                       
CONECT   37   36   30   30   34                                       
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   19                                                      
CONECT   59   20                                                      
CONECT   60   20                                                      
CONECT   61   21                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   24                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   35                                                      
CONECT   70   36                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
