COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.101   6.501  -0.141  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.223   4.256   0.276  1.00  0.00           N  
HETATM    3  O   UNL     1      -2.328   2.483  -1.054  1.00  0.00           O  
HETATM    4  C   UNL     1      -2.941   5.084  -0.697  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.447   0.687   0.704  1.00  0.00           N  
HETATM    6  O   UNL     1      -3.660   0.694   0.901  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.966   2.962   0.000  1.00  0.00           C  
HETATM    8  N   UNL     1       2.186   0.897   0.257  1.00  0.00           N  
HETATM    9  O   UNL     1      -2.139  -3.468  -0.013  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.228   2.110   1.000  1.00  0.00           C  
HETATM   11  N   UNL     1       6.333  -0.851  -0.661  1.00  0.00           N  
HETATM   12  O   UNL     1       2.479   0.136  -1.810  1.00  0.00           O  
HETATM   13  C   UNL     1       0.289   2.372   0.895  1.00  0.00           C  
HETATM   14  N   UNL     1       5.235  -0.600  -1.278  1.00  0.00           N  
HETATM   15  C   UNL     1       0.780   1.210  -0.009  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.143   0.052   0.446  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.643   0.065   0.678  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.717  -1.373   0.379  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.678  -2.243   0.264  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.485  -3.479  -0.097  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.412  -4.481  -0.356  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.759  -4.184  -0.376  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.202  -2.892  -0.139  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.297  -1.885   0.120  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.936  -2.172   0.143  1.00  0.00           C  
HETATM   26  C   UNL     1       2.939   0.317  -0.699  1.00  0.00           C  
HETATM   27  C   UNL     1       4.319  -0.098  -0.398  1.00  0.00           C  
HETATM   28  C   UNL     1       4.948  -0.058   0.835  1.00  0.00           C  
HETATM   29  C   UNL     1       6.235  -0.551   0.609  1.00  0.00           C  
HETATM   30  C   UNL     1       7.319  -0.710   1.644  1.00  0.00           C  
HETATM   31  C   UNL     1       7.815  -2.157   1.644  1.00  0.00           C  
HETATM   32  C   UNL     1       5.000  -0.818  -2.707  1.00  0.00           C  
HETATM   33  H   UNL     1      -3.634   7.117  -0.865  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.665   6.464   0.791  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.117   6.931   0.047  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.934   4.639   1.119  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.924   4.654  -0.885  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.376   5.121  -1.629  1.00  0.00           H  
HETATM   39  H   UNL     1       2.575   1.107   1.120  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.577   2.337   2.008  1.00  0.00           H  
HETATM   41  H   UNL     1       0.482   3.336   0.423  1.00  0.00           H  
HETATM   42  H   UNL     1       0.758   2.321   1.877  1.00  0.00           H  
HETATM   43  H   UNL     1       0.626   1.443  -1.062  1.00  0.00           H  
HETATM   44  H   UNL     1       0.243  -0.405   1.357  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.233  -0.693  -0.345  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.636  -1.983   0.380  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.078  -5.491  -0.542  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.475  -4.966  -0.578  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.259  -2.674  -0.158  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.642  -0.878   0.305  1.00  0.00           H  
HETATM   51  H   UNL     1       4.532   0.283   1.771  1.00  0.00           H  
HETATM   52  H   UNL     1       8.147  -0.041   1.409  1.00  0.00           H  
HETATM   53  H   UNL     1       6.920  -0.463   2.628  1.00  0.00           H  
HETATM   54  H   UNL     1       6.987  -2.826   1.880  1.00  0.00           H  
HETATM   55  H   UNL     1       8.214  -2.404   0.660  1.00  0.00           H  
HETATM   56  H   UNL     1       8.599  -2.272   2.393  1.00  0.00           H  
HETATM   57  H   UNL     1       4.519  -1.785  -2.853  1.00  0.00           H  
HETATM   58  H   UNL     1       4.355  -0.029  -3.094  1.00  0.00           H  
HETATM   59  H   UNL     1       5.952  -0.801  -3.238  1.00  0.00           H  
CONECT    1    4   33   34   35                                       
CONECT    2    4    7   36                                            
CONECT    3    7    7                                                 
CONECT    4    1    2   37   38                                       
CONECT    5   10   16   17                                            
CONECT    6   17   17                                                 
CONECT    7    2    3    3   10                                       
CONECT    8   15   26   39                                            
CONECT    9   19   20                                                 
CONECT   10    5    7   13   40                                       
CONECT   11   14   29   29                                            
CONECT   12   26   26                                                 
CONECT   13   10   15   41   42                                       
CONECT   14   11   27   32                                            
CONECT   15    8   13   16   43                                       
CONECT   16    5   15   44   45                                       
CONECT   17    5    6    6   18                                       
CONECT   18   17   19   19   25                                       
CONECT   19    9   18   18   46                                       
CONECT   20    9   21   21   25                                       
CONECT   21   20   20   22   47                                       
CONECT   22   21   23   23   48                                       
CONECT   23   22   22   24   49                                       
CONECT   24   23   25   25   50                                       
CONECT   25   18   20   24   24                                       
CONECT   26    8   12   12   27                                       
CONECT   27   14   26   28   28                                       
CONECT   28   27   27   29   51                                       
CONECT   29   11   11   28   30                                       
CONECT   30   29   31   52   53                                       
CONECT   31   30   54   55   56                                       
CONECT   32   14   57   58   59                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   28                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
