COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.594   0.446   0.000  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.856  -0.478   0.000  1.00  0.00           C  
HETATM    3  C   UNL     1       0.643  -0.505   0.000  1.00  0.00           C  
HETATM    4  C   UNL     1       3.141  -0.532   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1       6.898   0.311   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       8.138  -0.586   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1       9.396   0.283   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1      11.895   0.256   0.000  1.00  0.00           C  
HETATM    9  C   UNL     1      14.374   0.216   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1     -16.846  -0.315   0.000  1.00  0.00           C  
HETATM   11  C   UNL     1     -15.587   0.555   0.000  1.00  0.00           C  
HETATM   12  C   UNL     1     -14.347  -0.342   0.000  1.00  0.00           C  
HETATM   13  C   UNL     1     -13.089   0.527   0.000  1.00  0.00           C  
HETATM   14  C   UNL     1     -11.849  -0.369   0.000  1.00  0.00           C  
HETATM   15  C   UNL     1     -10.590   0.500   0.000  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.351  -0.396   0.000  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.092   0.473   0.000  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.852  -0.424   0.000  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.354  -0.451   0.000  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.095   0.419   0.000  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.597   0.392   0.000  1.00  0.00           C  
HETATM   22  C   UNL     1       1.901   0.365   0.000  1.00  0.00           C  
HETATM   23  C   UNL     1       4.400   0.338   0.000  1.00  0.00           C  
HETATM   24  C   UNL     1       5.639  -0.559   0.000  1.00  0.00           C  
HETATM   25  C   UNL     1      10.636  -0.613   0.000  1.00  0.00           C  
HETATM   26  C   UNL     1      13.134  -0.641   0.000  1.00  0.00           C  
HETATM   27  O   UNL     1      15.587  -0.359   0.000  1.00  0.00           O  
HETATM   28  O   UNL     1      14.276   1.420   0.001  1.00  0.00           O  
HETATM   29  H   UNL     1      -5.587   1.076  -0.889  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.587   1.075   0.891  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.862  -1.107   0.889  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.862  -1.107  -0.891  1.00  0.00           H  
HETATM   33  H   UNL     1       0.636  -1.135   0.889  1.00  0.00           H  
HETATM   34  H   UNL     1       0.636  -1.134  -0.891  1.00  0.00           H  
HETATM   35  H   UNL     1       3.134  -1.162   0.889  1.00  0.00           H  
HETATM   36  H   UNL     1       3.134  -1.161  -0.891  1.00  0.00           H  
HETATM   37  H   UNL     1       6.905   0.939   0.891  1.00  0.00           H  
HETATM   38  H   UNL     1       6.905   0.940  -0.890  1.00  0.00           H  
HETATM   39  H   UNL     1       8.131  -1.216   0.889  1.00  0.00           H  
HETATM   40  H   UNL     1       8.131  -1.215  -0.891  1.00  0.00           H  
HETATM   41  H   UNL     1       9.403   0.913  -0.890  1.00  0.00           H  
HETATM   42  H   UNL     1       9.403   0.912   0.891  1.00  0.00           H  
HETATM   43  H   UNL     1      11.902   0.886  -0.890  1.00  0.00           H  
HETATM   44  H   UNL     1      11.902   0.885   0.890  1.00  0.00           H  
HETATM   45  H   UNL     1     -17.729   0.324   0.000  1.00  0.00           H  
HETATM   46  H   UNL     1     -16.852  -0.944  -0.891  1.00  0.00           H  
HETATM   47  H   UNL     1     -16.852  -0.945   0.890  1.00  0.00           H  
HETATM   48  H   UNL     1     -15.580   1.184  -0.889  1.00  0.00           H  
HETATM   49  H   UNL     1     -15.580   1.184   0.891  1.00  0.00           H  
HETATM   50  H   UNL     1     -14.354  -0.972   0.890  1.00  0.00           H  
HETATM   51  H   UNL     1     -14.354  -0.971  -0.891  1.00  0.00           H  
HETATM   52  H   UNL     1     -13.082   1.157  -0.889  1.00  0.00           H  
HETATM   53  H   UNL     1     -13.082   1.156   0.891  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.856  -0.999   0.890  1.00  0.00           H  
HETATM   55  H   UNL     1     -11.856  -0.998  -0.891  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.583   1.130  -0.889  1.00  0.00           H  
HETATM   57  H   UNL     1     -10.583   1.129   0.891  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.357  -1.026   0.889  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.357  -1.025  -0.891  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.085   1.103  -0.889  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.085   1.102   0.891  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.859  -1.052  -0.891  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.859  -1.053   0.889  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.361  -1.080   0.889  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.361  -1.079  -0.891  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.088   1.048   0.891  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.088   1.049  -0.889  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.590   1.022  -0.889  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.590   1.021   0.891  1.00  0.00           H  
HETATM   70  H   UNL     1       1.908   0.994  -0.890  1.00  0.00           H  
HETATM   71  H   UNL     1       1.908   0.994   0.891  1.00  0.00           H  
HETATM   72  H   UNL     1       4.407   0.967  -0.890  1.00  0.00           H  
HETATM   73  H   UNL     1       4.407   0.966   0.891  1.00  0.00           H  
HETATM   74  H   UNL     1       5.633  -1.188  -0.891  1.00  0.00           H  
HETATM   75  H   UNL     1       5.633  -1.189   0.889  1.00  0.00           H  
HETATM   76  H   UNL     1      10.629  -1.243   0.889  1.00  0.00           H  
HETATM   77  H   UNL     1      10.629  -1.242  -0.891  1.00  0.00           H  
HETATM   78  H   UNL     1      13.128  -1.270   0.889  1.00  0.00           H  
HETATM   79  H   UNL     1      13.128  -1.269  -0.891  1.00  0.00           H  
HETATM   80  H   UNL     1      16.353   0.232   0.000  1.00  0.00           H  
CONECT    1   18   19   29   30                                       
CONECT    2   20   21   31   32                                       
CONECT    3   21   22   33   34                                       
CONECT    4   22   23   35   36                                       
CONECT    5   24    6   37   38                                       
CONECT    6    5    7   39   40                                       
CONECT    7    6   25   41   42                                       
CONECT    8   25   26   43   44                                       
CONECT    9   28   28   26   27                                       
CONECT   10   11   45   46   47                                       
CONECT   11   10   12   48   49                                       
CONECT   12   11   13   50   51                                       
CONECT   13   12   14   52   53                                       
CONECT   14   13   15   54   55                                       
CONECT   15   14   16   56   57                                       
CONECT   16   15   17   58   59                                       
CONECT   17   16   18   60   61                                       
CONECT   18   17    1   62   63                                       
CONECT   19    1   20   64   65                                       
CONECT   20   19    2   66   67                                       
CONECT   21    2    3   68   69                                       
CONECT   22    3    4   70   71                                       
CONECT   23    4   24   72   73                                       
CONECT   24   23    5   74   75                                       
CONECT   25    7    8   76   77                                       
CONECT   26    8    9   78   79                                       
CONECT   27    9   80                                                 
CONECT   28    9    9                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   13                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   18                                                      
CONECT   63   18                                                      
CONECT   64   19                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   20                                                      
CONECT   68   21                                                      
CONECT   69   21                                                      
CONECT   70   22                                                      
CONECT   71   22                                                      
CONECT   72   23                                                      
CONECT   73   23                                                      
CONECT   74   24                                                      
CONECT   75   24                                                      
CONECT   76   25                                                      
CONECT   77   25                                                      
CONECT   78   26                                                      
CONECT   79   26                                                      
CONECT   80   27                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
