COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.743  -0.935   0.807  1.00  0.00           N  
HETATM    2  N   UNL     1       3.806  -0.364  -3.664  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.851   0.946  -2.490  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.274  -1.425  -1.825  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.267   2.133   0.193  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.042   3.691   0.540  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.370  -1.311   1.188  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.717  -3.312   0.742  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.802  -4.757   2.523  1.00  0.00           C  
HETATM   10  C   UNL     1       0.615  -0.700   0.226  1.00  0.00           C  
HETATM   11  C   UNL     1       4.055   0.582   0.413  1.00  0.00           C  
HETATM   12  C   UNL     1       4.247   3.362   3.071  1.00  0.00           C  
HETATM   13  C   UNL     1       3.372  -1.069  -1.333  1.00  0.00           C  
HETATM   14  C   UNL     1       4.238  -0.430  -2.389  1.00  0.00           C  
HETATM   15  O   UNL     1       0.240  -0.309  -0.859  1.00  0.00           O  
HETATM   16  N   UNL     1       1.913  -0.588   0.570  1.00  0.00           N  
HETATM   17  C   UNL     1       2.871   0.006  -0.366  1.00  0.00           C  
HETATM   18  O   UNL     1       5.322   0.024  -2.091  1.00  0.00           O  
HETATM   19  C   UNL     1       4.692   0.151  -4.711  1.00  0.00           C  
HETATM   20  O   UNL     1       2.256  -1.708  -1.955  1.00  0.00           O  
HETATM   21  C   UNL     1       3.559   1.684   1.353  1.00  0.00           C  
HETATM   22  C   UNL     1       4.743   2.260   2.132  1.00  0.00           C  
HETATM   23  F   UNL     1       5.674   2.796   1.236  1.00  0.00           F  
HETATM   24  F   UNL     1       5.347   1.245   2.881  1.00  0.00           F  
HETATM   25  C   UNL     1      -0.284  -2.847   1.122  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.074  -3.392   2.555  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.052  -4.499   1.657  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.592  -2.100   1.143  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.145   0.234   0.269  1.00  0.00           C  
HETATM   30  O   UNL     1      -1.353   1.141   0.130  1.00  0.00           O  
HETATM   31  C   UNL     1      -3.579   0.413  -0.160  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.722   0.025  -1.633  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.185   0.167  -2.058  1.00  0.00           C  
HETATM   34  N   UNL     1      -3.970   1.813   0.017  1.00  0.00           N  
HETATM   35  O   UNL     1      -6.112   1.260   0.205  1.00  0.00           O  
HETATM   36  O   UNL     1      -5.627   3.420   0.355  1.00  0.00           O  
HETATM   37  H   UNL     1       2.909  -0.657  -3.889  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.954   0.670  -3.540  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.171   1.979  -2.353  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.809   0.845  -2.188  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.257  -1.543  -1.451  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.942  -2.088  -1.276  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.303  -1.677  -2.885  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.596   3.340  -0.331  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.398   3.173   1.430  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.194   4.764   0.659  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.160  -0.972   2.203  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.806  -3.566  -0.314  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.169  -5.516   2.063  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.091  -5.061   3.529  1.00  0.00           H  
HETATM   51  H   UNL     1       4.526  -0.208   0.997  1.00  0.00           H  
HETATM   52  H   UNL     1       4.780   1.000  -0.285  1.00  0.00           H  
HETATM   53  H   UNL     1       3.776   4.153   2.488  1.00  0.00           H  
HETATM   54  H   UNL     1       3.521   2.944   3.769  1.00  0.00           H  
HETATM   55  H   UNL     1       5.090   3.773   3.626  1.00  0.00           H  
HETATM   56  H   UNL     1       3.955  -1.808  -0.784  1.00  0.00           H  
HETATM   57  H   UNL     1       2.214  -0.901   1.438  1.00  0.00           H  
HETATM   58  H   UNL     1       2.384   0.802  -0.928  1.00  0.00           H  
HETATM   59  H   UNL     1       4.173   0.128  -5.670  1.00  0.00           H  
HETATM   60  H   UNL     1       4.976   1.177  -4.475  1.00  0.00           H  
HETATM   61  H   UNL     1       5.587  -0.469  -4.768  1.00  0.00           H  
HETATM   62  H   UNL     1       1.655  -2.141  -1.334  1.00  0.00           H  
HETATM   63  H   UNL     1       3.088   2.474   0.769  1.00  0.00           H  
HETATM   64  H   UNL     1       2.833   1.266   2.051  1.00  0.00           H  
HETATM   65  H   UNL     1       0.480  -3.194   0.426  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.531  -2.729   3.289  1.00  0.00           H  
HETATM   67  H   UNL     1       0.987  -3.526   2.764  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.902  -4.252   2.293  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.278  -5.380   1.057  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.810  -2.121   2.211  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.514  -2.084   0.562  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.222  -0.224   0.447  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.806  -0.489  -1.447  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.505   1.200  -1.921  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.288  -0.109  -3.107  1.00  0.00           H  
HETATM   76  H   UNL     1      -3.296   2.510   0.007  1.00  0.00           H  
CONECT    1   29    7   28                                            
CONECT    2   14   19   37                                            
CONECT    3   32   38   39   40                                       
CONECT    4   32   41   42   43                                       
CONECT    5   34   36   35   35                                       
CONECT    6   36   44   45   46                                       
CONECT    7   10    1   25   47                                       
CONECT    8   25   28   27   48                                       
CONECT    9   26   27   49   50                                       
CONECT   10   16   15   15    7                                       
CONECT   11   21   17   51   52                                       
CONECT   12   22   53   54   55                                       
CONECT   13   14   17   20   56                                       
CONECT   14   18   18    2   13                                       
CONECT   15   10   10                                                 
CONECT   16   17   10   57                                            
CONECT   17   11   13   16   58                                       
CONECT   18   14   14                                                 
CONECT   19    2   59   60   61                                       
CONECT   20   13   62                                                 
CONECT   21   22   11   63   64                                       
CONECT   22   24   12   23   21                                       
CONECT   23   22                                                      
CONECT   24   22                                                      
CONECT   25    7   26    8   65                                       
CONECT   26   25    9   66   67                                       
CONECT   27    9    8   68   69                                       
CONECT   28    1    8   70   71                                       
CONECT   29   30   30   31    1                                       
CONECT   30   29   29                                                 
CONECT   31   32   29   34   72                                       
CONECT   32    4    3   31   33                                       
CONECT   33   32   73   74   75                                       
CONECT   34   31    5   76                                            
CONECT   35    5    5                                                 
CONECT   36    5    6                                                 
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   11                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   21                                                      
CONECT   64   21                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   31                                                      
CONECT   73   33                                                      
CONECT   74   33                                                      
CONECT   75   33                                                      
CONECT   76   34                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
