COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.544   1.719  -0.951  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.301   0.449  -1.274  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.352   0.488  -1.867  1.00  0.00           O  
HETATM    4  C   UNL     1      -4.706  -0.870  -0.834  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.366  -0.782   0.658  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.613  -2.051   1.070  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.212   1.718   0.544  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.343  -2.182   0.227  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.447  -0.966   0.459  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.204   0.308   0.051  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.467   0.433   0.902  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.336   1.551   0.215  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.012   1.415  -0.556  1.00  0.00           C  
HETATM   14  C   UNL     1       0.685   0.171  -0.041  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.205  -1.047  -0.408  1.00  0.00           C  
HETATM   16  C   UNL     1       0.738  -2.220  -0.118  1.00  0.00           C  
HETATM   17  C   UNL     1       2.097  -1.719  -0.680  1.00  0.00           C  
HETATM   18  C   UNL     1       2.027  -0.172  -0.678  1.00  0.00           C  
HETATM   19  C   UNL     1       0.841   0.257   1.479  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.077   0.485   2.381  1.00  0.00           C  
HETATM   21  C   UNL     1       3.172   0.409   0.154  1.00  0.00           C  
HETATM   22  C   UNL     1       3.064   1.935   0.174  1.00  0.00           C  
HETATM   23  C   UNL     1       4.510   0.000  -0.463  1.00  0.00           C  
HETATM   24  C   UNL     1       5.653   0.475   0.437  1.00  0.00           C  
HETATM   25  C   UNL     1       6.972   0.072  -0.172  1.00  0.00           C  
HETATM   26  O   UNL     1       8.121   0.385   0.448  1.00  0.00           O  
HETATM   27  O   UNL     1       6.995  -0.533  -1.218  1.00  0.00           O  
HETATM   28  H   UNL     1      -3.622   1.754  -1.532  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.161   2.585  -1.190  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.428  -1.670  -0.998  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.799  -1.070  -1.405  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.283  -0.682   1.239  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.345  -1.989   2.125  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.250  -2.921   0.908  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.585   2.578   0.777  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.135   1.775   1.121  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.808  -3.087   0.514  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.612  -2.239  -0.828  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.172  -0.908   1.512  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.503   0.221  -0.994  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.880   2.418  -0.160  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.119   1.697   1.273  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.212   1.313  -1.622  1.00  0.00           H  
HETATM   44  H   UNL     1       0.612   2.291  -0.378  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.477  -1.016  -1.464  1.00  0.00           H  
HETATM   46  H   UNL     1       0.808  -2.402   0.954  1.00  0.00           H  
HETATM   47  H   UNL     1       0.409  -3.118  -0.641  1.00  0.00           H  
HETATM   48  H   UNL     1       2.914  -2.057  -0.043  1.00  0.00           H  
HETATM   49  H   UNL     1       2.238  -2.086  -1.697  1.00  0.00           H  
HETATM   50  H   UNL     1       2.070   0.209  -1.698  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.140   0.380   1.938  1.00  0.00           H  
HETATM   52  H   UNL     1       1.304  -0.657   1.849  1.00  0.00           H  
HETATM   53  H   UNL     1       1.470   1.111   1.731  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.540  -0.426   2.647  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.437   1.349   2.558  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.976   0.568   2.991  1.00  0.00           H  
HETATM   57  H   UNL     1       3.110   0.027   1.173  1.00  0.00           H  
HETATM   58  H   UNL     1       2.111   2.227   0.614  1.00  0.00           H  
HETATM   59  H   UNL     1       3.880   2.349   0.767  1.00  0.00           H  
HETATM   60  H   UNL     1       3.126   2.317  -0.845  1.00  0.00           H  
HETATM   61  H   UNL     1       4.550  -1.085  -0.559  1.00  0.00           H  
HETATM   62  H   UNL     1       4.610   0.456  -1.448  1.00  0.00           H  
HETATM   63  H   UNL     1       5.614   1.560   0.532  1.00  0.00           H  
HETATM   64  H   UNL     1       5.553   0.019   1.422  1.00  0.00           H  
HETATM   65  H   UNL     1       8.941   0.105   0.020  1.00  0.00           H  
CONECT    1    2    7   28   29                                       
CONECT    2    4    3    3    1                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   30   31                                       
CONECT    5    4    6   11   32                                       
CONECT    6    8    5   33   34                                       
CONECT    7    1   11   35   36                                       
CONECT    8    9    6   37   38                                       
CONECT    9   15    8   10   39                                       
CONECT   10    9   12   11   40                                       
CONECT   11   10    5    7   20                                       
CONECT   12   13   10   41   42                                       
CONECT   13   14   12   43   44                                       
CONECT   14   18   15   13   19                                       
CONECT   15   16   14    9   45                                       
CONECT   16   17   15   46   47                                       
CONECT   17   18   16   48   49                                       
CONECT   18   21   17   14   50                                       
CONECT   19   14   51   52   53                                       
CONECT   20   11   54   55   56                                       
CONECT   21   23   22   18   57                                       
CONECT   22   21   58   59   60                                       
CONECT   23   24   21   61   62                                       
CONECT   24   25   23   63   64                                       
CONECT   25   27   27   26   24                                       
CONECT   26   25   65                                                 
CONECT   27   25   25                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   17                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   22                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   24                                                      
CONECT   64   24                                                      
CONECT   65   26                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
