COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  O   UNL     1      -7.027  -3.605   1.645  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.480  -2.745   0.978  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.067  -1.598   1.554  1.00  0.00           N  
HETATM    4  C   UNL     1      -5.463  -0.647   0.817  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.095   0.382   1.350  1.00  0.00           O  
HETATM    6  C   UNL     1      -6.268  -2.942  -0.408  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.715  -4.216  -1.075  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.660  -1.972  -1.123  1.00  0.00           C  
HETATM    9  N   UNL     1      -5.259  -0.820  -0.502  1.00  0.00           N  
HETATM   10  C   UNL     1      -4.599   0.232  -1.278  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.338   0.588  -0.671  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.435   1.531  -1.243  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.378   2.656  -1.178  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.480   3.506  -2.323  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.029   1.903  -1.181  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.024   2.607  -0.266  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.772   1.921  -0.317  1.00  0.00           O  
HETATM   18  P   UNL     1       0.518   2.388   0.526  1.00  0.00           P  
HETATM   19  O   UNL     1       0.165   2.476   1.961  1.00  0.00           O  
HETATM   20  O   UNL     1       1.007   3.830   0.004  1.00  0.00           O  
HETATM   21  O   UNL     1       1.704   1.316   0.330  1.00  0.00           O  
HETATM   22  P   UNL     1       3.037   0.959   1.159  1.00  0.00           P  
HETATM   23  O   UNL     1       2.655   0.031   2.418  1.00  0.00           O  
HETATM   24  O   UNL     1       3.667   2.209   1.641  1.00  0.00           O  
HETATM   25  O   UNL     1       4.067   0.172   0.205  1.00  0.00           O  
HETATM   26  O   UNL     1       5.243  -3.625  -1.757  1.00  0.00           O  
HETATM   27  C   UNL     1       5.768  -2.636  -0.869  1.00  0.00           C  
HETATM   28  C   UNL     1       4.863  -2.518   0.359  1.00  0.00           C  
HETATM   29  O   UNL     1       5.358  -1.488   1.217  1.00  0.00           O  
HETATM   30  C   UNL     1       4.851  -3.849   1.114  1.00  0.00           C  
HETATM   31  C   UNL     1       5.824  -1.283  -1.586  1.00  0.00           C  
HETATM   32  N   UNL     1       6.750  -1.367  -2.723  1.00  0.00           N  
HETATM   33  C   UNL     1       6.314  -0.216  -0.603  1.00  0.00           C  
HETATM   34  O   UNL     1       6.303   1.062  -1.240  1.00  0.00           O  
HETATM   35  C   UNL     1       5.387  -0.192   0.616  1.00  0.00           C  
HETATM   36  H   UNL     1      -6.206  -1.457   2.504  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.181  -4.869  -0.337  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.436  -3.983  -1.859  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.853  -4.720  -1.512  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.489  -2.105  -2.182  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.446  -0.096  -2.307  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.035   1.623  -2.148  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.071   1.552  -0.358  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.492   3.235  -0.262  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.332   3.957  -2.403  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.635   1.834  -2.196  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.888   3.636  -0.599  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.400   2.603   0.757  1.00  0.00           H  
HETATM   49  H   UNL     1       1.255   3.847  -0.930  1.00  0.00           H  
HETATM   50  H   UNL     1       2.236  -0.807   2.176  1.00  0.00           H  
HETATM   51  H   UNL     1       5.177  -4.508  -1.367  1.00  0.00           H  
HETATM   52  H   UNL     1       6.772  -2.924  -0.556  1.00  0.00           H  
HETATM   53  H   UNL     1       3.849  -2.271   0.042  1.00  0.00           H  
HETATM   54  H   UNL     1       5.864  -4.095   1.432  1.00  0.00           H  
HETATM   55  H   UNL     1       4.206  -3.765   1.989  1.00  0.00           H  
HETATM   56  H   UNL     1       4.474  -4.635   0.459  1.00  0.00           H  
HETATM   57  H   UNL     1       4.829  -1.020  -1.945  1.00  0.00           H  
HETATM   58  H   UNL     1       6.804  -0.486  -3.212  1.00  0.00           H  
HETATM   59  H   UNL     1       7.665  -1.670  -2.422  1.00  0.00           H  
HETATM   60  H   UNL     1       7.329  -0.455  -0.283  1.00  0.00           H  
HETATM   61  H   UNL     1       6.602   1.787  -0.674  1.00  0.00           H  
HETATM   62  H   UNL     1       5.755   0.536   1.339  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    6                                       
CONECT    3    2    4   36                                            
CONECT    4    3    5    5    9                                       
CONECT    5    4    4                                                 
CONECT    6    2    7    8    8                                       
CONECT    7    6   37   38   39                                       
CONECT    8    6    6    9   40                                       
CONECT    9    4    8   10                                            
CONECT   10    9   11   12   41                                       
CONECT   11   10   15                                                 
CONECT   12   10   13   42   43                                       
CONECT   13   12   15   14   44                                       
CONECT   14   13   45                                                 
CONECT   15   11   13   16   46                                       
CONECT   16   15   17   47   48                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   19   20                                       
CONECT   18   21                                                      
CONECT   19   18   18                                                 
CONECT   20   18   49                                                 
CONECT   21   18   22                                                 
CONECT   22   21   24   24   23                                       
CONECT   22   25                                                      
CONECT   23   22   50                                                 
CONECT   24   22   22                                                 
CONECT   25   22   35                                                 
CONECT   26   27   51                                                 
CONECT   27   26   28   31   52                                       
CONECT   28   27   29   30   53                                       
CONECT   29   28   35                                                 
CONECT   30   28   54   55   56                                       
CONECT   31   27   33   32   57                                       
CONECT   32   31   58   59                                            
CONECT   33   31   34   35   60                                       
CONECT   34   33   61                                                 
CONECT   35   25   29   33   62                                       
CONECT   36    3                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
