COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.074   0.488   2.283  1.00  0.00           C  
HETATM    2  C   UNL     1       5.317  -0.741   1.404  1.00  0.00           C  
HETATM    3  C   UNL     1       4.416  -0.672   0.170  1.00  0.00           C  
HETATM    4  C   UNL     1       4.747  -1.834  -0.769  1.00  0.00           C  
HETATM    5  C   UNL     1       3.952  -1.683  -2.067  1.00  0.00           C  
HETATM    6  O   UNL     1       3.048  -0.760   0.573  1.00  0.00           O  
HETATM    7  C   UNL     1       2.160   0.047  -0.203  1.00  0.00           C  
HETATM    8  C   UNL     1       0.734  -0.509  -0.099  1.00  0.00           C  
HETATM    9  N   UNL     1       0.736  -1.935  -0.433  1.00  0.00           N  
HETATM   10  C   UNL     1      -0.032  -2.792   0.268  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.031  -4.260  -0.076  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.726  -2.383   1.174  1.00  0.00           O  
HETATM   13  C   UNL     1       2.168   1.480   0.332  1.00  0.00           C  
HETATM   14  C   UNL     1       1.061   2.273  -0.299  1.00  0.00           C  
HETATM   15  C   UNL     1       1.125   3.739  -0.216  1.00  0.00           C  
HETATM   16  O   UNL     1       0.245   4.415  -0.713  1.00  0.00           O  
HETATM   17  O   UNL     1       2.160   4.334   0.410  1.00  0.00           O  
HETATM   18  C   UNL     1       0.034   1.732  -0.919  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.156   0.249  -1.085  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.558  -0.093  -0.832  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.367   0.502   0.075  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.232  -1.007  -1.437  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.433  -1.050  -0.977  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.565  -0.120  -0.025  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.805   0.176   0.780  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.970   0.467  -0.168  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.196   0.889   0.646  1.00  0.00           C  
HETATM   28  O   UNL     1      -5.124  -0.953   1.596  1.00  0.00           O  
HETATM   29  H   UNL     1       5.302   1.391   1.716  1.00  0.00           H  
HETATM   30  H   UNL     1       4.030   0.510   2.596  1.00  0.00           H  
HETATM   31  H   UNL     1       5.715   0.439   3.162  1.00  0.00           H  
HETATM   32  H   UNL     1       6.361  -0.763   1.092  1.00  0.00           H  
HETATM   33  H   UNL     1       5.089  -1.643   1.971  1.00  0.00           H  
HETATM   34  H   UNL     1       4.582   0.273  -0.349  1.00  0.00           H  
HETATM   35  H   UNL     1       5.814  -1.827  -0.993  1.00  0.00           H  
HETATM   36  H   UNL     1       4.484  -2.776  -0.288  1.00  0.00           H  
HETATM   37  H   UNL     1       4.279  -0.785  -2.592  1.00  0.00           H  
HETATM   38  H   UNL     1       4.121  -2.555  -2.700  1.00  0.00           H  
HETATM   39  H   UNL     1       2.890  -1.602  -1.836  1.00  0.00           H  
HETATM   40  H   UNL     1       2.479   0.044  -1.246  1.00  0.00           H  
HETATM   41  H   UNL     1       0.361  -0.371   0.916  1.00  0.00           H  
HETATM   42  H   UNL     1       1.291  -2.263  -1.158  1.00  0.00           H  
HETATM   43  H   UNL     1       0.743  -4.767   0.501  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.003  -4.690   0.162  1.00  0.00           H  
HETATM   45  H   UNL     1       0.171  -4.383  -1.140  1.00  0.00           H  
HETATM   46  H   UNL     1       2.029   1.463   1.413  1.00  0.00           H  
HETATM   47  H   UNL     1       3.124   1.948   0.098  1.00  0.00           H  
HETATM   48  H   UNL     1       2.159   5.301   0.438  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.715   2.390  -1.334  1.00  0.00           H  
HETATM   50  H   UNL     1       0.105  -0.036  -2.105  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.109   1.309   0.743  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.627   1.044   1.414  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.693   1.270  -0.850  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.206  -0.431  -0.740  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.473   0.085   1.328  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.960   1.786   1.218  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.026   1.096  -0.029  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.295  -1.763   1.097  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    3    1   32   33                                       
CONECT    3    6    2    4   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    4   37   38   39                                       
CONECT    6    7    3                                                 
CONECT    7   13    8    6   40                                       
CONECT    8   19    7    9   41                                       
CONECT    9    8   10   42                                            
CONECT   10   12   12    9   11                                       
CONECT   11   10   43   44   45                                       
CONECT   12   10   10                                                 
CONECT   13   14    7   46   47                                       
CONECT   14   15   18   18   13                                       
CONECT   15   16   16   14   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   48                                                 
CONECT   18   14   14   19   49                                       
CONECT   19   18   20    8   50                                       
CONECT   20   22   19   21                                            
CONECT   21   24   24   20   51                                       
CONECT   22   23   23   20                                            
CONECT   23   22   22   24                                            
CONECT   24   23   25   21   21                                       
CONECT   25   24   26   28   52                                       
CONECT   26   27   25   53   54                                       
CONECT   27   26   55   56   57                                       
CONECT   28   25   58                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   13                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   21                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   26                                                      
CONECT   55   27                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
