COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.721   0.907  -0.704  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.044   1.517  -1.073  1.00  0.00           C  
HETATM    3  O   UNL     1      -7.963   0.496  -1.467  1.00  0.00           O  
HETATM    4  C   UNL     1      -8.046  -0.579  -0.524  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.722  -1.348  -0.549  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.574  -0.380  -0.469  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.236  -0.890  -0.106  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.158  -0.006  -0.021  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.069  -2.184   0.143  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.895  -2.680   0.471  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.777  -1.860   0.569  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.578  -2.387   0.909  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.913  -0.498   0.320  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.732   0.416   0.417  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.756   1.450  -0.727  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.395   2.571  -0.080  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.191   2.451   1.248  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.819   1.262   1.616  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.359   3.490   2.130  1.00  0.00           N  
HETATM   20  C   UNL     1       0.558  -0.349   0.398  1.00  0.00           C  
HETATM   21  C   UNL     1       1.740   0.312   0.131  1.00  0.00           C  
HETATM   22  C   UNL     1       0.569  -1.718   0.641  1.00  0.00           C  
HETATM   23  C   UNL     1       1.772  -2.416   0.618  1.00  0.00           C  
HETATM   24  C   UNL     1       2.954  -1.758   0.357  1.00  0.00           C  
HETATM   25  C   UNL     1       2.945  -0.387   0.109  1.00  0.00           C  
HETATM   26  C   UNL     1       4.214   0.326  -0.178  1.00  0.00           C  
HETATM   27  C   UNL     1       5.424  -0.368  -0.208  1.00  0.00           C  
HETATM   28  C   UNL     1       4.214   1.698  -0.427  1.00  0.00           C  
HETATM   29  N   UNL     1       5.336   2.339  -0.683  1.00  0.00           N  
HETATM   30  C   UNL     1       6.500   1.724  -0.716  1.00  0.00           C  
HETATM   31  C   UNL     1       6.590   0.350  -0.488  1.00  0.00           C  
HETATM   32  C   UNL     1       7.859  -0.312  -0.525  1.00  0.00           C  
HETATM   33  C   UNL     1       8.900  -0.854  -0.556  1.00  0.00           C  
HETATM   34  C   UNL     1      10.205  -1.535  -0.594  1.00  0.00           C  
HETATM   35  H   UNL     1      -4.856   1.550  -0.633  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.447   2.054  -0.214  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.219  -0.178   0.475  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.865  -1.245  -0.798  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.683  -2.031   0.300  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.296   1.046  -0.220  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.799  -3.738   0.666  1.00  0.00           H  
HETATM   42  H   UNL     1       0.255   1.706  -1.045  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.350   1.091  -1.568  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.198   3.354   3.076  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.638   4.361   1.806  1.00  0.00           H  
HETATM   46  H   UNL     1       1.731   1.375  -0.060  1.00  0.00           H  
HETATM   47  H   UNL     1       1.780  -3.479   0.808  1.00  0.00           H  
HETATM   48  H   UNL     1       3.885  -2.305   0.340  1.00  0.00           H  
HETATM   49  H   UNL     1       5.458  -1.431  -0.019  1.00  0.00           H  
HETATM   50  H   UNL     1       3.281   2.243  -0.410  1.00  0.00           H  
HETATM   51  H   UNL     1       7.396   2.288  -0.931  1.00  0.00           H  
HETATM   52  H   UNL     1      10.067  -2.597  -0.393  1.00  0.00           H  
HETATM   53  H   UNL     1      10.653  -1.406  -1.580  1.00  0.00           H  
HETATM   54  H   UNL     1      10.861  -1.104   0.162  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.903   2.213  -1.900  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.650  -1.917  -1.475  1.00  0.00           H  
CONECT    1    6    6    2   35                                       
CONECT    2    1    3   36   55                                       
CONECT    3    4    2                                                 
CONECT    4    5    3   37   38                                       
CONECT    5    4    6   39   56                                       
CONECT    6    5    7    1    1                                       
CONECT    7    8    6    9    9                                       
CONECT    8   13   13    7   40                                       
CONECT    9    7    7   10                                            
CONECT   10   11   11    9   41                                       
CONECT   11   13   12   10   10                                       
CONECT   12   22   11                                                 
CONECT   13   14    8    8   11                                       
CONECT   14   18   20   15   13                                       
CONECT   15   16   14   42   43                                       
CONECT   16   17   15                                                 
CONECT   17   19   18   18   16                                       
CONECT   18   17   17   14                                            
CONECT   19   17   44   45                                            
CONECT   20   21   21   14   22                                       
CONECT   21   25   20   20   46                                       
CONECT   22   20   23   23   12                                       
CONECT   23   24   22   22   47                                       
CONECT   24   25   25   23   48                                       
CONECT   25   26   21   24   24                                       
CONECT   26   27   27   28   25                                       
CONECT   27   31   26   26   49                                       
CONECT   28   29   29   26   50                                       
CONECT   29   30   28   28                                            
CONECT   30   31   31   29   51                                       
CONECT   31   32   30   30   27                                       
CONECT   32   33   33   33   31                                       
CONECT   33   34   32   32   32                                       
CONECT   34   33   52   53   54                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   30                                                      
CONECT   52   34                                                      
CONECT   53   34                                                      
CONECT   54   34                                                      
CONECT   55    2                                                      
CONECT   56    5                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
