COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.750   0.997   1.779  1.00  0.00           O  
HETATM    2  O   UNL     1      -3.066  -3.375  -0.355  1.00  0.00           O  
HETATM    3  C   UNL     1       3.201   0.139   0.840  1.00  0.00           C  
HETATM    4  C   UNL     1       5.255  -1.186   0.302  1.00  0.00           C  
HETATM    5  C   UNL     1       7.381  -0.126  -0.003  1.00  0.00           C  
HETATM    6  C   UNL     1       6.800   1.106   0.234  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.246   1.943  -0.394  1.00  0.00           C  
HETATM    8  C   UNL     1       5.449   1.191   0.516  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.342   1.818   1.111  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.130  -0.290  -2.045  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.735  -1.454  -1.824  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.359  -2.268  -0.660  1.00  0.00           C  
HETATM   13  C   UNL     1       0.949   0.290  -0.188  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.637  -4.131   0.809  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.411  -1.944   0.028  1.00  0.00           O  
HETATM   16  C   UNL     1      -3.552  -5.343   0.995  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.368   0.386  -0.935  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.788   1.855  -0.849  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.823   3.345  -0.696  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.741   3.577   0.526  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.181   2.748   1.599  1.00  0.00           N  
HETATM   22  N   UNL     1       0.069   0.304  -1.208  1.00  0.00           N  
HETATM   23  O   UNL     1       0.550   0.253   0.957  1.00  0.00           O  
HETATM   24  C   UNL     1       2.430   0.319  -0.469  1.00  0.00           C  
HETATM   25  C   UNL     1       2.802   1.663  -1.100  1.00  0.00           C  
HETATM   26  C   UNL     1       4.676   0.045   0.544  1.00  0.00           C  
HETATM   27  C   UNL     1       6.608  -1.272   0.031  1.00  0.00           C  
HETATM   28  H   UNL     1       3.015   0.992   1.492  1.00  0.00           H  
HETATM   29  H   UNL     1       2.871  -0.775   1.333  1.00  0.00           H  
HETATM   30  H   UNL     1       4.652  -2.082   0.328  1.00  0.00           H  
HETATM   31  H   UNL     1       8.438  -0.193  -0.214  1.00  0.00           H  
HETATM   32  H   UNL     1       7.403   2.001   0.207  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.843   1.171  -0.880  1.00  0.00           H  
HETATM   34  H   UNL     1       4.996   2.153   0.701  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.184   0.170  -3.021  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.503  -1.801  -2.500  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.611  -4.469   0.665  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.690  -3.497   1.694  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.230  -5.910   1.868  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.578  -5.005   1.139  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.500  -5.977   0.110  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.587  -0.110   0.011  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.684   2.320  -1.829  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.151   2.374  -0.132  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.031   4.093  -0.736  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.399   3.339  -1.621  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.726   4.628   0.814  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.759   3.264   0.297  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.389   2.857   2.540  1.00  0.00           H  
HETATM   50  H   UNL     1       0.387   0.261  -2.124  1.00  0.00           H  
HETATM   51  H   UNL     1       2.685  -0.488  -1.156  1.00  0.00           H  
HETATM   52  H   UNL     1       3.853   1.649  -1.390  1.00  0.00           H  
HETATM   53  H   UNL     1       2.184   1.834  -1.981  1.00  0.00           H  
HETATM   54  H   UNL     1       2.635   2.462  -0.377  1.00  0.00           H  
HETATM   55  H   UNL     1       7.062  -2.235  -0.154  1.00  0.00           H  
CONECT    1    9    9                                                 
CONECT    2   12   14                                                 
CONECT    3   24   26   28   29                                       
CONECT    4   26   26   27   30                                       
CONECT    5    6   27   27   31                                       
CONECT    6    8    8    5   32                                       
CONECT    7    9   18   19   33                                       
CONECT    8    6    6   26   34                                       
CONECT    9    1    1   21    7                                       
CONECT   10   17   11   11   35                                       
CONECT   11   10   10   12   36                                       
CONECT   12   11   15   15    2                                       
CONECT   13   22   24   23   23                                       
CONECT   14    2   16   37   38                                       
CONECT   15   12   12                                                 
CONECT   16   14   39   40   41                                       
CONECT   17   18   10   22   42                                       
CONECT   18    7   17   43   44                                       
CONECT   19    7   20   45   46                                       
CONECT   20   21   19   47   48                                       
CONECT   21    9   20   49                                            
CONECT   22   17   13   50                                            
CONECT   23   13   13                                                 
CONECT   24   13   25    3   51                                       
CONECT   25   24   52   53   54                                       
CONECT   26    8    3    4    4                                       
CONECT   27    5    5    4   55                                       
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   25                                                      
CONECT   54   25                                                      
CONECT   55   27                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
