COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.236   2.610  -0.702  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.196   0.307   1.183  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.192   1.238   0.997  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.794   1.581  -0.282  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.700   2.597  -0.484  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.366   1.897  -0.528  1.00  0.00           C  
HETATM    7  C   UNL     1       0.145   0.681  -1.146  1.00  0.00           C  
HETATM    8  C   UNL     1       3.794   0.038  -0.516  1.00  0.00           C  
HETATM    9  C   UNL     1       5.620  -1.039  -1.655  1.00  0.00           C  
HETATM   10  C   UNL     1       7.608  -1.913  -0.416  1.00  0.00           C  
HETATM   11  C   UNL     1       6.656  -4.049  -1.298  1.00  0.00           C  
HETATM   12  C   UNL     1       5.677  -0.787   0.737  1.00  0.00           C  
HETATM   13  C   UNL     1       4.437  -0.153   0.702  1.00  0.00           C  
HETATM   14  C   UNL     1       2.332   2.006  -0.063  1.00  0.00           C  
HETATM   15  C   UNL     1       3.521   2.721   0.524  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.404   0.059  -1.190  1.00  0.00           C  
HETATM   17  C   UNL     1       7.411  -3.404  -0.134  1.00  0.00           C  
HETATM   18  C   UNL     1       8.775  -4.078   0.025  1.00  0.00           C  
HETATM   19  C   UNL     1       6.267  -1.227  -0.451  1.00  0.00           C  
HETATM   20  C   UNL     1       6.347  -0.987   1.988  1.00  0.00           C  
HETATM   21  N   UNL     1       6.878  -1.146   2.979  1.00  0.00           N  
HETATM   22  C   UNL     1       4.390  -0.411  -1.694  1.00  0.00           C  
HETATM   23  C   UNL     1       2.473   0.712  -0.562  1.00  0.00           C  
HETATM   24  C   UNL     1       1.105   2.632  -0.112  1.00  0.00           C  
HETATM   25  F   UNL     1       4.576   2.704  -0.395  1.00  0.00           F  
HETATM   26  F   UNL     1       3.173   4.046   0.810  1.00  0.00           F  
HETATM   27  F   UNL     1       3.918   2.078   1.701  1.00  0.00           F  
HETATM   28  C   UNL     1       1.371   0.052  -1.105  1.00  0.00           C  
HETATM   29  C   UNL     1       0.007   1.973  -0.653  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.310   0.691  -0.408  1.00  0.00           O  
HETATM   31  C   UNL     1      -5.400   0.991  -1.375  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.798  -0.287   0.089  1.00  0.00           C  
HETATM   33  S   UNL     1      -8.078  -1.475   0.326  1.00  0.00           S  
HETATM   34  O   UNL     1      -8.633  -1.145   1.591  1.00  0.00           O  
HETATM   35  O   UNL     1      -8.857  -1.392  -0.860  1.00  0.00           O  
HETATM   36  C   UNL     1      -7.210  -3.066   0.407  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.225  -4.191   0.613  1.00  0.00           C  
HETATM   38  H   UNL     1      -1.286   3.565  -0.865  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.507   0.040   2.182  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.718   1.699   1.852  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.864   3.126  -1.423  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.709   3.310   0.341  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.709   0.170  -1.567  1.00  0.00           H  
HETATM   44  H   UNL     1       6.076  -1.385  -2.571  1.00  0.00           H  
HETATM   45  H   UNL     1       8.222  -1.473   0.369  1.00  0.00           H  
HETATM   46  H   UNL     1       8.105  -1.789  -1.378  1.00  0.00           H  
HETATM   47  H   UNL     1       5.684  -3.569  -1.411  1.00  0.00           H  
HETATM   48  H   UNL     1       7.231  -3.926  -2.216  1.00  0.00           H  
HETATM   49  H   UNL     1       6.516  -5.111  -1.097  1.00  0.00           H  
HETATM   50  H   UNL     1       3.977   0.190   1.617  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.875  -0.405  -2.044  1.00  0.00           H  
HETATM   52  H   UNL     1       6.836  -3.527   0.784  1.00  0.00           H  
HETATM   53  H   UNL     1       9.313  -3.619   0.855  1.00  0.00           H  
HETATM   54  H   UNL     1       8.635  -5.140   0.226  1.00  0.00           H  
HETATM   55  H   UNL     1       9.350  -3.955  -0.893  1.00  0.00           H  
HETATM   56  H   UNL     1       3.889  -0.267  -2.640  1.00  0.00           H  
HETATM   57  H   UNL     1       0.995   3.635   0.275  1.00  0.00           H  
HETATM   58  H   UNL     1       1.478  -0.950  -1.492  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.093   1.262  -2.374  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.667  -3.232  -0.524  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.507  -3.054   1.240  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.703  -5.147   0.662  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.768  -4.025   1.544  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.928  -4.203  -0.220  1.00  0.00           H  
CONECT    1   29    6   38                                            
CONECT    2   32    3    3   39                                       
CONECT    3    2    2    4   40                                       
CONECT    4   31   31    3    5                                       
CONECT    5    4    6   41   42                                       
CONECT    6    1   30   30    5                                       
CONECT    7   29   29   28   43                                       
CONECT    8   13   23   22   22                                       
CONECT    9   19   19   22   44                                       
CONECT   10   19   17   45   46                                       
CONECT   11   17   47   48   49                                       
CONECT   12   20   13   13   19                                       
CONECT   13   12   12    8   50                                       
CONECT   14   15   24   24   23                                       
CONECT   15   25   27   26   14                                       
CONECT   16   32   32   31   51                                       
CONECT   17   10   11   18   52                                       
CONECT   18   17   53   54   55                                       
CONECT   19   12   10    9    9                                       
CONECT   20   21   21   21   12                                       
CONECT   21   20   20   20                                            
CONECT   22    8    8    9   56                                       
CONECT   23   14    8   28   28                                       
CONECT   24   14   14   29   57                                       
CONECT   25   15                                                      
CONECT   26   15                                                      
CONECT   27   15                                                      
CONECT   28   23   23    7   58                                       
CONECT   29   24    1    7    7                                       
CONECT   30    6    6                                                 
CONECT   31   16    4    4   59                                       
CONECT   32   33   16   16    2                                       
CONECT   33   35   35   36   34                                       
CONECT   33   34   32                                                 
CONECT   34   33   33                                                 
CONECT   35   33   33                                                 
CONECT   36   37   33   60   61                                       
CONECT   37   36   62   63   64                                       
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   13                                                      
CONECT   51   16                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   22                                                      
CONECT   57   24                                                      
CONECT   58   28                                                      
CONECT   59   31                                                      
CONECT   60   36                                                      
CONECT   61   36                                                      
CONECT   62   37                                                      
CONECT   63   37                                                      
CONECT   64   37                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
