COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.971   3.486   1.398  1.00  0.00           C  
HETATM    2  C   UNL     1       5.086   4.131   0.983  1.00  0.00           C  
HETATM    3  C   UNL     1       5.978   5.014   1.818  1.00  0.00           C  
HETATM    4  O   UNL     1       5.242   3.833  -0.314  1.00  0.00           O  
HETATM    5  N   UNL     1       4.369   3.100  -0.715  1.00  0.00           N  
HETATM    6  C   UNL     1       3.520   2.800   0.237  1.00  0.00           C  
HETATM    7  C   UNL     1       2.327   1.925   0.125  1.00  0.00           C  
HETATM    8  O   UNL     1       1.620   1.736   1.094  1.00  0.00           O  
HETATM    9  C   UNL     1       3.522  -4.700   0.884  1.00  0.00           C  
HETATM   10  C   UNL     1       4.884  -2.851  -0.095  1.00  0.00           C  
HETATM   11  C   UNL     1       7.086  -2.440  -0.941  1.00  0.00           C  
HETATM   12  C   UNL     1       5.091  -1.912   0.899  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.387   1.269  -0.825  1.00  0.00           C  
HETATM   14  C   UNL     1       0.850   0.477  -1.163  1.00  0.00           C  
HETATM   15  C   UNL     1       0.986  -0.697  -0.191  1.00  0.00           C  
HETATM   16  C   UNL     1       2.152  -1.558  -0.604  1.00  0.00           C  
HETATM   17  C   UNL     1       1.752  -3.132   1.311  1.00  0.00           C  
HETATM   18  C   UNL     1       2.050  -4.651   1.374  1.00  0.00           C  
HETATM   19  C   UNL     1       3.569  -3.582  -0.179  1.00  0.00           C  
HETATM   20  C   UNL     1       5.882  -3.115  -1.014  1.00  0.00           C  
HETATM   21  C   UNL     1       7.293  -1.502   0.053  1.00  0.00           C  
HETATM   22  C   UNL     1       6.295  -1.237   0.972  1.00  0.00           C  
HETATM   23  N   UNL     1       2.464  -2.657   0.111  1.00  0.00           N  
HETATM   24  N   UNL     1       2.028   1.341  -1.052  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.294   2.296  -0.186  1.00  0.00           O  
HETATM   26  O   UNL     1       2.809  -1.262  -1.579  1.00  0.00           O  
HETATM   27  C   UNL     1      -9.886  -0.782   1.059  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.291  -0.986  -1.323  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.003   2.704  -1.948  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.799   1.605  -0.903  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.996   0.689  -0.897  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.970  -0.169  -0.473  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.333  -0.382   0.061  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.621  -0.075   1.393  1.00  0.00           C  
HETATM   35  C   UNL     1      -8.897  -0.277   1.884  1.00  0.00           C  
HETATM   36  C   UNL     1      -9.606  -1.089  -0.260  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.336  -0.891  -0.764  1.00  0.00           C  
HETATM   38  F   UNL     1      -6.656   0.418   2.199  1.00  0.00           F  
HETATM   39  N   UNL     1      -5.138   0.895  -0.206  1.00  0.00           N  
HETATM   40  N   UNL     1      -4.096  -0.432  -1.558  1.00  0.00           N  
HETATM   41  N   UNL     1      -1.597   0.836  -1.232  1.00  0.00           N  
HETATM   42  H   UNL     1       3.529   3.488   2.384  1.00  0.00           H  
HETATM   43  H   UNL     1       6.761   4.410   2.275  1.00  0.00           H  
HETATM   44  H   UNL     1       6.431   5.776   1.184  1.00  0.00           H  
HETATM   45  H   UNL     1       5.387   5.494   2.598  1.00  0.00           H  
HETATM   46  H   UNL     1       4.208  -4.484   1.702  1.00  0.00           H  
HETATM   47  H   UNL     1       3.748  -5.669   0.439  1.00  0.00           H  
HETATM   48  H   UNL     1       7.866  -2.647  -1.659  1.00  0.00           H  
HETATM   49  H   UNL     1       4.311  -1.705   1.617  1.00  0.00           H  
HETATM   50  H   UNL     1       0.772   0.098  -2.182  1.00  0.00           H  
HETATM   51  H   UNL     1       1.153  -0.317   0.817  1.00  0.00           H  
HETATM   52  H   UNL     1       0.072  -1.291  -0.209  1.00  0.00           H  
HETATM   53  H   UNL     1       0.680  -2.960   1.210  1.00  0.00           H  
HETATM   54  H   UNL     1       2.134  -2.632   2.201  1.00  0.00           H  
HETATM   55  H   UNL     1       1.396  -5.206   0.702  1.00  0.00           H  
HETATM   56  H   UNL     1       1.966  -5.024   2.395  1.00  0.00           H  
HETATM   57  H   UNL     1       3.445  -4.008  -1.174  1.00  0.00           H  
HETATM   58  H   UNL     1       5.721  -3.849  -1.790  1.00  0.00           H  
HETATM   59  H   UNL     1       8.234  -0.974   0.110  1.00  0.00           H  
HETATM   60  H   UNL     1       6.456  -0.503   1.748  1.00  0.00           H  
HETATM   61  H   UNL     1       2.593   1.493  -1.826  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.880  -0.943   1.449  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.652  -1.918  -1.732  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.898   3.276  -1.703  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.138   3.366  -1.952  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.119   2.251  -2.933  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.683   2.058   0.082  1.00  0.00           H  
HETATM   68  H   UNL     1      -9.122  -0.041   2.914  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.383  -1.483  -0.899  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.120  -1.130  -1.795  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.335   1.651   0.370  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.671   0.014  -1.743  1.00  0.00           H  
CONECT    1    6    2    2   42                                       
CONECT    2    3    1    1    4                                       
CONECT    3    2   43   44   45                                       
CONECT    4    2    5                                                 
CONECT    5    6    6    4                                            
CONECT    6    7    1    5    5                                       
CONECT    7    8    8   24    6                                       
CONECT    8    7    7                                                 
CONECT    9   19   18   46   47                                       
CONECT   10   19   20   20   12                                       
CONECT   11   21   21   20   48                                       
CONECT   12   10   22   22   49                                       
CONECT   13   41   25   25   14                                       
CONECT   14   15   13   24   50                                       
CONECT   15   14   16   51   52                                       
CONECT   16   15   23   26   26                                       
CONECT   17   18   23   53   54                                       
CONECT   18    9   17   55   56                                       
CONECT   19   10   23    9   57                                       
CONECT   20   10   10   11   58                                       
CONECT   21   22   11   11   59                                       
CONECT   22   12   12   21   60                                       
CONECT   23   16   19   17                                            
CONECT   24    7   14   61                                            
CONECT   25   13   13                                                 
CONECT   26   16   16                                                 
CONECT   27   36   36   35   62                                       
CONECT   28   32   32   40   63                                       
CONECT   29   30   64   65   66                                       
CONECT   30   29   31   41   67                                       
CONECT   31   30   39   40   40                                       
CONECT   32   28   28   33   39                                       
CONECT   33   32   37   37   34                                       
CONECT   34   33   35   35   38                                       
CONECT   35   27   34   34   68                                       
CONECT   36   27   27   37   69                                       
CONECT   37   33   33   36   70                                       
CONECT   38   34                                                      
CONECT   39   31   32   71                                            
CONECT   40   28   31   31                                            
CONECT   41   30   13   72                                            
CONECT   42    1                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    3                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   30                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   37                                                      
CONECT   71   39                                                      
CONECT   72   41                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
