COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.252  -1.861  -0.498  1.00  0.00           C  
HETATM    2  C   UNL     1       3.790  -1.848   0.774  1.00  0.00           C  
HETATM    3  C   UNL     1       5.678  -0.225   0.526  1.00  0.00           C  
HETATM    4  C   UNL     1       7.119   1.580   1.475  1.00  0.00           C  
HETATM    5  C   UNL     1       7.851   0.417  -0.522  1.00  0.00           C  
HETATM    6  C   UNL     1       6.430  -0.076  -0.800  1.00  0.00           C  
HETATM    7  C   UNL     1       3.431   0.145  -0.512  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.807  -0.979  -0.275  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.306  -0.929   0.517  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.355   3.106  -2.202  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.403   1.547  -0.744  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.318   0.712  -0.950  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.266  -0.529  -0.319  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.103  -1.425  -0.538  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.289  -2.723  -1.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.023  -3.141  -0.977  1.00  0.00           C  
HETATM   17  C   UNL     1       1.650  -1.440  -0.235  1.00  0.00           C  
HETATM   18  C   UNL     1       2.490  -2.244   0.532  1.00  0.00           C  
HETATM   19  C   UNL     1       4.259  -0.655   0.255  1.00  0.00           C  
HETATM   20  C   UNL     1       5.675   1.121   1.256  1.00  0.00           C  
HETATM   21  C   UNL     1       9.139   2.279   0.338  1.00  0.00           C  
HETATM   22  C   UNL     1       2.131  -0.244  -0.764  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.557   0.415   0.238  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.390  -0.093   0.721  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.287  -1.767   2.152  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.441   1.146   0.091  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.420   2.889   1.381  1.00  0.00           C  
HETATM   28  N   UNL     1      -1.262  -3.524  -1.209  1.00  0.00           N  
HETATM   29  N   UNL     1       7.795   1.708   0.177  1.00  0.00           N  
HETATM   30  O   UNL     1      -4.455   2.759  -1.359  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.405  -0.482   1.538  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.507   1.968   0.293  1.00  0.00           O  
HETATM   33  H   UNL     1       4.440  -2.469   1.372  1.00  0.00           H  
HETATM   34  H   UNL     1       6.174  -0.974   1.144  1.00  0.00           H  
HETATM   35  H   UNL     1       7.121   2.545   1.982  1.00  0.00           H  
HETATM   36  H   UNL     1       7.644   0.847   2.087  1.00  0.00           H  
HETATM   37  H   UNL     1       8.373  -0.310   0.100  1.00  0.00           H  
HETATM   38  H   UNL     1       8.385   0.538  -1.464  1.00  0.00           H  
HETATM   39  H   UNL     1       6.472  -1.041  -1.304  1.00  0.00           H  
HETATM   40  H   UNL     1       5.912   0.644  -1.433  1.00  0.00           H  
HETATM   41  H   UNL     1       3.803   1.076  -0.915  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.268  -1.893   1.003  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.522   4.095  -2.629  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.436   3.113  -1.616  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.268   2.374  -3.005  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.513   1.023  -1.599  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.289  -3.077  -1.218  1.00  0.00           H  
HETATM   48  H   UNL     1       0.790  -3.830  -1.153  1.00  0.00           H  
HETATM   49  H   UNL     1       2.124  -3.176   0.938  1.00  0.00           H  
HETATM   50  H   UNL     1       5.146   1.860   0.655  1.00  0.00           H  
HETATM   51  H   UNL     1       5.179   1.011   2.220  1.00  0.00           H  
HETATM   52  H   UNL     1       9.735   1.630   0.980  1.00  0.00           H  
HETATM   53  H   UNL     1       9.617   2.362  -0.638  1.00  0.00           H  
HETATM   54  H   UNL     1       9.062   3.267   0.791  1.00  0.00           H  
HETATM   55  H   UNL     1       1.487   0.379  -1.366  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.394   1.088  -0.604  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.422   0.752   0.810  1.00  0.00           H  
HETATM   58  H   UNL     1       0.324   0.415   0.878  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.221  -2.534   1.380  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.388  -1.794   2.769  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.161  -1.954   2.776  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.294   2.339   2.314  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.565   3.549   1.231  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.333   3.482   1.430  1.00  0.00           H  
CONECT    1   16   16    8   17                                       
CONECT    2   18   19   19   33                                       
CONECT    3   20   19    6   34                                       
CONECT    4   20   29   35   36                                       
CONECT    5   29    6   37   38                                       
CONECT    6    3    5   39   40                                       
CONECT    7   22   22   19   41                                       
CONECT    8   14   14    1   23                                       
CONECT    9   24   24   13   42                                       
CONECT   10   30   43   44   45                                       
CONECT   11   26   26   12   30                                       
CONECT   12   13   13   11   46                                       
CONECT   13    9   14   12   12                                       
CONECT   14   15   13    8    8                                       
CONECT   15   28   28   14   47                                       
CONECT   16   28    1    1   48                                       
CONECT   17    1   18   18   22                                       
CONECT   18   17   17    2   49                                       
CONECT   19    2    2    7    3                                       
CONECT   20    4    3   50   51                                       
CONECT   21   29   52   53   54                                       
CONECT   22   17    7    7   55                                       
CONECT   23    8   56   57   58                                       
CONECT   24   31    9    9   26                                       
CONECT   25   31   59   60   61                                       
CONECT   26   24   32   11   11                                       
CONECT   27   32   62   63   64                                       
CONECT   28   15   15   16                                            
CONECT   29    4    5   21                                            
CONECT   30   11   10                                                 
CONECT   31   25   24                                                 
CONECT   32   27   26                                                 
CONECT   33    2                                                      
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    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
