COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.541  -3.379   1.336  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.541  -4.185   0.910  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.321  -5.169   1.743  1.00  0.00           C  
HETATM    4  O   UNL     1      -5.703  -3.939  -0.398  1.00  0.00           O  
HETATM    5  N   UNL     1      -4.933  -3.096  -0.795  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.161  -2.659   0.169  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.099  -1.630   0.064  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.449  -1.325   1.044  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.292   4.283   1.952  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.164   3.485  -0.412  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.480  -0.620  -0.841  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.806  -0.015  -1.224  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.127   1.147  -0.282  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.390   1.830  -0.739  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.106   3.468   1.058  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.007   3.525   2.296  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.042   3.542   0.842  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.848   2.628  -1.478  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.869   2.888  -0.056  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.855  -1.032  -1.120  1.00  0.00           N  
HETATM   21  O   UNL     1      -0.445  -1.637  -0.182  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.976   1.426  -1.721  1.00  0.00           O  
HETATM   23  N   UNL     1       0.668  -0.031  -1.232  1.00  0.00           N  
HETATM   24  C   UNL     1       1.957  -0.619  -0.859  1.00  0.00           C  
HETATM   25  C   UNL     1       3.014   0.455  -0.848  1.00  0.00           C  
HETATM   26  O   UNL     1       2.720   1.599  -1.123  1.00  0.00           O  
HETATM   27  C   UNL     1       2.337  -1.698  -1.875  1.00  0.00           C  
HETATM   28  C   UNL     1       5.315   1.188  -0.520  1.00  0.00           C  
HETATM   29  C   UNL     1       6.641   0.582  -0.137  1.00  0.00           C  
HETATM   30  C   UNL     1       7.609   0.373  -1.101  1.00  0.00           C  
HETATM   31  C   UNL     1       8.825  -0.182  -0.752  1.00  0.00           C  
HETATM   32  C   UNL     1       9.076  -0.529   0.565  1.00  0.00           C  
HETATM   33  C   UNL     1       8.107  -0.320   1.532  1.00  0.00           C  
HETATM   34  C   UNL     1       6.891   0.242   1.182  1.00  0.00           C  
HETATM   35  F   UNL     1      10.264  -1.073   0.906  1.00  0.00           F  
HETATM   36  F   UNL     1       5.948   0.452   2.125  1.00  0.00           F  
HETATM   37  N   UNL     1       4.287   0.144  -0.531  1.00  0.00           N  
HETATM   38  H   UNL     1      -4.130  -3.298   2.331  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.195  -4.674   2.168  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.644  -6.001   1.117  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.689  -5.544   2.549  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.924   4.346   2.838  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.041   5.288   1.612  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.008   4.493  -0.797  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.755   0.352  -2.249  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.265   0.767   0.730  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.304   1.862  -0.293  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.783   4.475   0.794  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.236   2.846   1.268  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.485   4.041   3.102  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.256   2.512   2.612  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.271   2.529   1.172  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.968   4.070   0.615  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.915   1.598  -1.129  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.850   3.013  -1.666  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.267   2.662  -2.400  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.374  -1.275  -1.902  1.00  0.00           H  
HETATM   58  H   UNL     1       0.640   0.783  -1.759  1.00  0.00           H  
HETATM   59  H   UNL     1       1.880  -1.064   0.132  1.00  0.00           H  
HETATM   60  H   UNL     1       1.572  -2.475  -1.884  1.00  0.00           H  
HETATM   61  H   UNL     1       2.414  -1.253  -2.867  1.00  0.00           H  
HETATM   62  H   UNL     1       3.296  -2.136  -1.598  1.00  0.00           H  
HETATM   63  H   UNL     1       5.044   1.957   0.204  1.00  0.00           H  
HETATM   64  H   UNL     1       5.392   1.633  -1.512  1.00  0.00           H  
HETATM   65  H   UNL     1       7.414   0.643  -2.129  1.00  0.00           H  
HETATM   66  H   UNL     1       9.581  -0.346  -1.506  1.00  0.00           H  
HETATM   67  H   UNL     1       8.302  -0.590   2.559  1.00  0.00           H  
HETATM   68  H   UNL     1       4.522  -0.771  -0.311  1.00  0.00           H  
CONECT    1    6    2    2   38                                       
CONECT    2    1    1    4    3                                       
CONECT    3    2   39   40   41                                       
CONECT    4    2    5                                                 
CONECT    5    6    6    4                                            
CONECT    6    7    1    5    5                                       
CONECT    7    6    8    8   20                                       
CONECT    8    7    7                                                 
CONECT    9   16   17   42   43                                       
CONECT   10   18   19   17   44                                       
CONECT   11   23   21   21   12                                       
CONECT   12   11   13   20   45                                       
CONECT   13   12   14   46   47                                       
CONECT   14   13   19   22   22                                       
CONECT   15   19   16   48   49                                       
CONECT   16    9   15   50   51                                       
CONECT   17    9   10   52   53                                       
CONECT   18   10   54   55   56                                       
CONECT   19   10   14   15                                            
CONECT   20   12    7   57                                            
CONECT   21   11   11                                                 
CONECT   22   14   14                                                 
CONECT   23   24   11   58                                            
CONECT   24   25   27   23   59                                       
CONECT   25   37   26   26   24                                       
CONECT   26   25   25                                                 
CONECT   27   24   60   61   62                                       
CONECT   28   29   37   63   64                                       
CONECT   29   28   30   30   34                                       
CONECT   30   29   29   31   65                                       
CONECT   31   30   32   32   66                                       
CONECT   32   31   31   35   33                                       
CONECT   33   32   34   34   67                                       
CONECT   34   29   33   33   36                                       
CONECT   35   32                                                      
CONECT   36   34                                                      
CONECT   37   25   28   68                                            
CONECT   38    1                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
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   18                                                      
CONECT   57   20                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   33                                                      
CONECT   68   37                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
