COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.000   3.828  -0.067  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.800   2.187  -0.136  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.960   1.469   0.503  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.234   1.725  -0.311  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.290   0.732   0.104  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.887   1.475  -0.765  1.00  0.00           C  
HETATM    7  C   UNL     1      -8.420   0.327  -0.201  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.046  -0.418   0.769  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.663  -0.857   1.197  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.584  -0.484  -0.052  1.00  0.00           C  
HETATM   11  O   UNL     1       0.257   0.264  -0.515  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.393  -1.936  -0.124  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.778  -4.090   0.027  1.00  0.00           C  
HETATM   14  C   UNL     1       0.472  -3.953  -0.466  1.00  0.00           C  
HETATM   15  C   UNL     1       5.678  -0.051  -1.677  1.00  0.00           C  
HETATM   16  C   UNL     1       6.480   0.364  -0.599  1.00  0.00           C  
HETATM   17  C   UNL     1       8.386   1.343   0.217  1.00  0.00           C  
HETATM   18  C   UNL     1       7.949   1.125   1.524  1.00  0.00           C  
HETATM   19  C   UNL     1       6.035   0.143   0.730  1.00  0.00           C  
HETATM   20  C   UNL     1       4.799  -0.488   0.947  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.128   3.130   0.554  1.00  0.00           N  
HETATM   22  O   UNL     1      -0.471   1.918  -1.272  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.720   0.798  -0.116  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.541   1.742  -0.740  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.632  -0.624   0.423  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.261  -0.379   0.463  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.219  -1.089   0.987  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.691   0.023   0.526  1.00  0.00           N  
HETATM   29  O   UNL     1      -1.299  -2.873   0.227  1.00  0.00           O  
HETATM   30  C   UNL     1       0.729  -2.577  -0.563  1.00  0.00           C  
HETATM   31  C   UNL     1       1.997  -1.931  -1.061  1.00  0.00           C  
HETATM   32  N   UNL     1       2.811  -1.509   0.081  1.00  0.00           N  
HETATM   33  C   UNL     1       4.039  -0.882  -0.132  1.00  0.00           C  
HETATM   34  C   UNL     1       4.484  -0.655  -1.441  1.00  0.00           C  
HETATM   35  N   UNL     1       7.656   0.965  -0.808  1.00  0.00           N  
HETATM   36  N   UNL     1       6.797   0.538   1.757  1.00  0.00           N  
HETATM   37  H   UNL     1       0.656   4.351  -0.960  1.00  0.00           H  
HETATM   38  H   UNL     1       1.414   4.548   0.639  1.00  0.00           H  
HETATM   39  H   UNL     1       1.768   3.106  -0.342  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.099   1.832   1.521  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.591   2.737  -0.121  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.019   1.606  -1.373  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.552   2.182  -1.239  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.488   0.170  -0.249  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.563  -0.763   2.278  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.495  -1.892   0.899  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.278  -5.028   0.221  1.00  0.00           H  
HETATM   48  H   UNL     1       1.149  -4.752  -0.731  1.00  0.00           H  
HETATM   49  H   UNL     1       6.009   0.113  -2.692  1.00  0.00           H  
HETATM   50  H   UNL     1       9.336   1.827   0.046  1.00  0.00           H  
HETATM   51  H   UNL     1       8.563   1.443   2.353  1.00  0.00           H  
HETATM   52  H   UNL     1       4.448  -0.663   1.953  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.391   3.345   1.463  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.134   2.640  -1.183  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.060  -1.514   0.859  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.298  -1.941   1.444  1.00  0.00           H  
HETATM   57  H   UNL     1       2.557  -2.647  -1.662  1.00  0.00           H  
HETATM   58  H   UNL     1       1.747  -1.063  -1.670  1.00  0.00           H  
HETATM   59  H   UNL     1       2.497  -1.665   0.985  1.00  0.00           H  
HETATM   60  H   UNL     1       3.873  -0.971  -2.274  1.00  0.00           H  
CONECT    1   21   37   38   39                                       
CONECT    2    3   21   22   22                                       
CONECT    3   28    4    2   40                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    8    8   23                                       
CONECT    6   24   24    7   43                                       
CONECT    7   25   25    6   44                                       
CONECT    8    9    5    5   27                                       
CONECT    9   28    8   45   46                                       
CONECT   10   12   11   11   28                                       
CONECT   11   10   10                                                 
CONECT   12   30   30   29   10                                       
CONECT   13   14   14   29   47                                       
CONECT   14   30   13   13   48                                       
CONECT   15   34   34   16   49                                       
CONECT   16   15   35   35   19                                       
CONECT   17   35   18   18   50                                       
CONECT   18   17   17   36   51                                       
CONECT   19   16   20   36   36                                       
CONECT   20   33   33   19   52                                       
CONECT   21    2    1   53                                            
CONECT   22    2    2                                                 
CONECT   23    5   26   26   24                                       
CONECT   24   23    6    6   54                                       
CONECT   25   26    7    7   55                                       
CONECT   26   27   23   23   25                                       
CONECT   27    8   26   56                                            
CONECT   28   10    9    3                                            
CONECT   29   13   12                                                 
CONECT   30   31   14   12   12                                       
CONECT   31   32   30   57   58                                       
CONECT   32   33   31   59                                            
CONECT   33   34   32   20   20                                       
CONECT   34   15   15   33   60                                       
CONECT   35   16   16   17                                            
CONECT   36   19   19   18                                            
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   27                                                      
CONECT   57   31                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   34                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
