COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.250   0.993  -0.048  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.129   1.186   1.042  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.463   0.101   1.855  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.941  -1.133   1.592  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.073  -1.330   0.519  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.730  -0.272  -0.308  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.919   2.157  -0.883  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.481   3.342  -0.551  1.00  0.00           N  
HETATM    9  C   UNL     1      -5.317   3.436   0.517  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.628   2.427   1.272  1.00  0.00           N  
HETATM   11  O   UNL     1      -3.168   2.058  -1.836  1.00  0.00           O  
HETATM   12  N   UNL     1      -3.552  -2.603   0.271  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.207  -2.751  -0.078  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.726  -3.990  -0.483  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.396  -4.137  -0.828  1.00  0.00           C  
HETATM   16  C   UNL     1       0.459  -3.054  -0.773  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.015  -1.812  -0.369  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.351  -1.659  -0.027  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.655  -5.175  -0.544  1.00  0.00           C  
HETATM   20  N   UNL     1       0.850  -0.714  -0.318  1.00  0.00           N  
HETATM   21  C   UNL     1       2.142  -0.891   0.020  1.00  0.00           C  
HETATM   22  C   UNL     1       3.085   0.246  -0.046  1.00  0.00           C  
HETATM   23  O   UNL     1       2.533  -1.984   0.380  1.00  0.00           O  
HETATM   24  C   UNL     1       4.426   0.066   0.299  1.00  0.00           C  
HETATM   25  C   UNL     1       5.302   1.130   0.229  1.00  0.00           C  
HETATM   26  C   UNL     1       4.854   2.373  -0.180  1.00  0.00           C  
HETATM   27  C   UNL     1       3.526   2.559  -0.522  1.00  0.00           C  
HETATM   28  C   UNL     1       2.640   1.503  -0.458  1.00  0.00           C  
HETATM   29  C   UNL     1       6.749   0.937   0.601  1.00  0.00           C  
HETATM   30  C   UNL     1       7.351  -0.078  -0.280  1.00  0.00           C  
HETATM   31  C   UNL     1       7.498   2.261   0.439  1.00  0.00           C  
HETATM   32  C   UNL     1       6.845   0.471   2.055  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.186   4.535  -1.349  1.00  0.00           C  
HETATM   34  N   UNL     1       7.815  -0.861  -0.959  1.00  0.00           N  
HETATM   35  H   UNL     1      -6.134   0.238   2.691  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.199  -1.967   2.228  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.058  -0.426  -1.139  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.745   4.400   0.749  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.123  -3.384   0.342  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.024  -5.101  -1.143  1.00  0.00           H  
HETATM   41  H   UNL     1       1.498  -3.172  -1.043  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.723  -0.695   0.287  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.107  -5.231  -1.534  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.092  -6.088  -0.350  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.437  -5.063   0.207  1.00  0.00           H  
HETATM   46  H   UNL     1       0.520   0.174  -0.526  1.00  0.00           H  
HETATM   47  H   UNL     1       4.777  -0.904   0.618  1.00  0.00           H  
HETATM   48  H   UNL     1       5.544   3.202  -0.232  1.00  0.00           H  
HETATM   49  H   UNL     1       3.182   3.532  -0.840  1.00  0.00           H  
HETATM   50  H   UNL     1       1.605   1.649  -0.729  1.00  0.00           H  
HETATM   51  H   UNL     1       7.053   3.013   1.091  1.00  0.00           H  
HETATM   52  H   UNL     1       8.545   2.122   0.708  1.00  0.00           H  
HETATM   53  H   UNL     1       7.430   2.593  -0.597  1.00  0.00           H  
HETATM   54  H   UNL     1       6.399   1.223   2.707  1.00  0.00           H  
HETATM   55  H   UNL     1       6.312  -0.472   2.171  1.00  0.00           H  
HETATM   56  H   UNL     1       7.892   0.332   2.324  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.914   4.621  -2.156  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.240   5.419  -0.715  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.184   4.451  -1.771  1.00  0.00           H  
CONECT    1    6    6    2    7                                       
CONECT    2    3    3    1   10                                       
CONECT    3    4    2    2   35                                       
CONECT    4    5    5    3   36                                       
CONECT    5   12    4    4    6                                       
CONECT    6    5    1    1   37                                       
CONECT    7    1   11   11    8                                       
CONECT    8    7    9   33                                            
CONECT    9   10   10    8   38                                       
CONECT   10    2    9    9                                            
CONECT   11    7    7                                                 
CONECT   12   13    5   39                                            
CONECT   13   18   12   14   14                                       
CONECT   14   13   13   15   19                                       
CONECT   15   16   16   14   40                                       
CONECT   16   17   15   15   41                                       
CONECT   17   20   18   18   16                                       
CONECT   18   17   17   13   42                                       
CONECT   19   14   43   44   45                                       
CONECT   20   21   17   46                                            
CONECT   21   22   23   23   20                                       
CONECT   22   24   24   28   21                                       
CONECT   23   21   21                                                 
CONECT   24   25   22   22   47                                       
CONECT   25   29   26   26   24                                       
CONECT   26   25   25   27   48                                       
CONECT   27   26   28   28   49                                       
CONECT   28   27   27   22   50                                       
CONECT   29   32   30   31   25                                       
CONECT   30   34   34   34   29                                       
CONECT   31   29   51   52   53                                       
CONECT   32   29   54   55   56                                       
CONECT   33    8   57   58   59                                       
CONECT   34   30   30   30                                            
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   31                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
