COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.913   0.565   0.141  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.604  -1.012   0.156  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.059   3.397  -0.056  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.414   2.487  -0.088  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.901   3.303   1.111  1.00  0.00           C  
HETATM    6  CA  UNL     1      -1.943  -3.386   0.290  1.00  0.00           C  
HETATM    7  C   UNL     1       7.200   0.695  -0.776  1.00  0.00           C  
HETATM    8  C   UNL     1       5.935   0.139  -0.795  1.00  0.00           C  
HETATM    9  C   UNL     1       5.850   0.252   1.595  1.00  0.00           C  
HETATM   10  C   UNL     1       2.835   0.427   0.281  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.885   1.577   0.064  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.824   3.190  -1.383  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.445  -3.727  -1.116  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.238   1.200   0.039  1.00  0.00           C  
HETATM   15  C   UNL     1       1.434  -0.187   0.260  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.741  -2.509  -1.717  1.00  0.00           C  
HETATM   17  C   UNL     1       5.260  -0.082   0.391  1.00  0.00           C  
HETATM   18  C   UNL     1       3.879  -0.688   0.371  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.551  -5.179   0.091  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.536  -4.639   0.939  1.00  0.00           C  
HETATM   21  C   UNL     1       7.791   1.028   0.429  1.00  0.00           C  
HETATM   22  C   UNL     1       7.939   0.929  -2.068  1.00  0.00           C  
HETATM   23  C   UNL     1       7.114   0.812   1.614  1.00  0.00           C  
HETATM   24  N   UNL     1       0.434   0.880   0.174  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.315  -0.700   0.186  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.552  -0.091   0.089  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.846   2.931   0.003  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.955   2.367  -0.037  1.00  0.00           N  
HETATM   29  N   UNL     1      -2.971  -2.346   0.205  1.00  0.00           N  
HETATM   30  H   UNL     1      -3.319   4.443  -0.112  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.861   1.493  -0.056  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.454   4.297   1.080  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.987   3.392   1.073  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.609   2.803   2.034  1.00  0.00           H  
HETATM   35  HA  UNL     1      -1.110  -3.025   0.893  1.00  0.00           H  
HETATM   36  H   UNL     1       5.474  -0.122  -1.736  1.00  0.00           H  
HETATM   37  H   UNL     1       5.320   0.083   2.522  1.00  0.00           H  
HETATM   38  H   UNL     1       2.994   1.001  -0.632  1.00  0.00           H  
HETATM   39  H   UNL     1       2.931   1.085   1.144  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.376   4.183  -1.415  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.477   2.608  -2.237  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.909   3.279  -1.421  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.746  -4.562  -1.061  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.292  -4.004  -1.744  1.00  0.00           H  
HETATM   45  H   UNL     1       1.339  -0.845  -0.604  1.00  0.00           H  
HETATM   46  H   UNL     1       1.275  -0.761   1.173  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.386  -2.752  -2.718  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.440  -1.675  -1.771  1.00  0.00           H  
HETATM   49  H   UNL     1       0.106  -2.233  -1.088  1.00  0.00           H  
HETATM   50  H   UNL     1       3.721  -1.261   1.284  1.00  0.00           H  
HETATM   51  H   UNL     1       3.784  -1.346  -0.493  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.972  -5.977   0.440  1.00  0.00           H  
HETATM   53  H1  UNL     1      -1.751  -5.380   1.083  1.00  0.00           H  
HETATM   54  H2  UNL     1      -2.971  -4.377   1.904  1.00  0.00           H  
HETATM   55  H   UNL     1       8.783   1.456   0.444  1.00  0.00           H  
HETATM   56  H   UNL     1       8.524   0.044  -2.318  1.00  0.00           H  
HETATM   57  H   UNL     1       7.223   1.129  -2.865  1.00  0.00           H  
HETATM   58  H   UNL     1       8.606   1.784  -1.955  1.00  0.00           H  
HETATM   59  H   UNL     1       7.575   1.073   2.555  1.00  0.00           H  
HETATM   60  H   UNL     1       0.716   1.807   0.140  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.909  -2.593   0.184  1.00  0.00           H  
CONECT    1   11   11   25   24                                       
CONECT    2   26   29   25   25                                       
CONECT    3   28   27   27   30                                       
CONECT    4   12    5   28   31                                       
CONECT    5    4   32   33   34                                       
CONECT    6   29   13   20   35                                       
CONECT    7    8    8   21   22                                       
CONECT    8   17    7    7   36                                       
CONECT    9   17   17   23   37                                       
CONECT   10   15   18   38   39                                       
CONECT   11   14   27    1    1                                       
CONECT   12    4   40   41   42                                       
CONECT   13   16    6   43   44                                       
CONECT   14   28   26   26   11                                       
CONECT   15   24   10   45   46                                       
CONECT   16   13   47   48   49                                       
CONECT   17   18    9    9    8                                       
CONECT   18   10   17   50   51                                       
CONECT   19   20   52                                                 
CONECT   20    6   19   53   54                                       
CONECT   21   23   23    7   55                                       
CONECT   22    7   56   57   58                                       
CONECT   23    9   21   21   59                                       
CONECT   24    1   15   60                                            
CONECT   25    2    2    1                                            
CONECT   26   14   14    2                                            
CONECT   27    3    3   11                                            
CONECT   28    4    3   14                                            
CONECT   29    2    6   61                                            
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   29                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
