COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.808  -0.460   1.640  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.726  -0.035   0.967  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.807  -0.946   0.533  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.142  -0.557   0.653  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.148  -1.409   0.247  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.839  -2.650  -0.279  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.514  -3.046  -0.402  1.00  0.00           C  
HETATM    8  O   UNL     1      -3.216  -4.267  -0.920  1.00  0.00           O  
HETATM    9  C   UNL     1      -4.315  -5.090  -1.316  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.496  -2.196  -0.003  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.763   1.266   0.620  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.791   1.750  -0.305  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.330   3.094   0.189  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.815   3.170   0.550  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.301   3.844  -0.724  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.774   2.198   1.169  1.00  0.00           C  
HETATM   17  C   UNL     1       0.426   2.250   0.259  1.00  0.00           C  
HETATM   18  C   UNL     1       0.472   3.170  -0.772  1.00  0.00           C  
HETATM   19  C   UNL     1       1.571   3.223  -1.611  1.00  0.00           C  
HETATM   20  C   UNL     1       2.628   2.357  -1.423  1.00  0.00           C  
HETATM   21  C   UNL     1       2.588   1.428  -0.385  1.00  0.00           C  
HETATM   22  C   UNL     1       3.722   0.494  -0.177  1.00  0.00           C  
HETATM   23  C   UNL     1       4.896   0.496  -0.858  1.00  0.00           C  
HETATM   24  N   UNL     1       5.651  -0.527  -0.346  1.00  0.00           N  
HETATM   25  C   UNL     1       6.962  -1.174  -0.498  1.00  0.00           C  
HETATM   26  C   UNL     1       6.828  -2.546   0.198  1.00  0.00           C  
HETATM   27  C   UNL     1       5.706  -2.272   1.223  1.00  0.00           C  
HETATM   28  C   UNL     1       4.922  -1.122   0.620  1.00  0.00           C  
HETATM   29  N   UNL     1       3.773  -0.505   0.725  1.00  0.00           N  
HETATM   30  C   UNL     1       1.481   1.382   0.460  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.387   0.412   1.064  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.181  -1.106   0.341  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.631  -3.313  -0.594  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.952  -5.285  -0.454  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.892  -4.578  -2.086  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.939  -6.033  -1.711  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.465  -2.503  -0.098  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.357   1.875  -1.297  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.605   1.027  -0.352  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.636   3.689   0.783  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.408   2.263   0.435  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.098   3.815   1.382  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.247   4.933  -0.731  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.557   3.380  -1.677  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.215   3.192   1.245  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.466   1.860   2.158  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.354   3.850  -0.924  1.00  0.00           H  
HETATM   48  H   UNL     1       1.601   3.944  -2.415  1.00  0.00           H  
HETATM   49  H   UNL     1       3.485   2.399  -2.078  1.00  0.00           H  
HETATM   50  H   UNL     1       5.181   1.174  -1.650  1.00  0.00           H  
HETATM   51  H   UNL     1       7.197  -1.309  -1.554  1.00  0.00           H  
HETATM   52  H   UNL     1       6.528  -3.316  -0.512  1.00  0.00           H  
HETATM   53  H   UNL     1       5.069  -3.149   1.336  1.00  0.00           H  
HETATM   54  H   UNL     1       1.444   0.664   1.266  1.00  0.00           H  
HETATM   55  H   UNL     1       7.735  -0.578  -0.013  1.00  0.00           H  
HETATM   56  H   UNL     1       7.756  -2.821   0.700  1.00  0.00           H  
HETATM   57  H   UNL     1       6.129  -1.981   2.185  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   11                                       
CONECT    3   10   10    4    2                                       
CONECT    4    5    5    3   31                                       
CONECT    5    6    4    4   32                                       
CONECT    6    7    7    5   33                                       
CONECT    7    8    6    6   10                                       
CONECT    8    9    7                                                 
CONECT    9    8   34   35   36                                       
CONECT   10    7    3    3   37                                       
CONECT   11    2   12   16                                            
CONECT   12   11   13   38   39                                       
CONECT   13   12   15   14   40                                       
CONECT   14   13   15   41   42                                       
CONECT   15   13   14   43   44                                       
CONECT   16   11   17   45   46                                       
CONECT   17   30   16   18   18                                       
CONECT   18   17   17   19   47                                       
CONECT   19   20   20   18   48                                       
CONECT   20   21   19   19   49                                       
CONECT   21   22   30   30   20                                       
CONECT   22   29   23   23   21                                       
CONECT   23   24   22   22   50                                       
CONECT   24   25   28   23                                            
CONECT   25   26   24   51   55                                       
CONECT   26   27   25   52   56                                       
CONECT   27   26   28   53   57                                       
CONECT   28   27   24   29   29                                       
CONECT   29   28   28   22                                            
CONECT   30   21   21   17   54                                       
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   23                                                      
CONECT   51   25                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   30                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
