COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.730  -4.567  -1.613  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.511  -5.121  -1.347  1.00  0.00           C  
HETATM    3  C   UNL     1       1.106  -3.387  -1.006  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.381  -4.495  -0.474  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.346   0.498   0.326  1.00  0.00           C  
HETATM    6  C   UNL     1       3.777   1.492  -0.647  1.00  0.00           C  
HETATM    7  C   UNL     1       4.718   0.255   1.176  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.900   1.577  -0.344  1.00  0.00           C  
HETATM    9  C   UNL     1       5.045   1.849  -1.064  1.00  0.00           C  
HETATM   10  C   UNL     1       5.988   0.608   0.763  1.00  0.00           C  
HETATM   11  C   UNL     1       0.232  -2.750  -0.123  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.188   1.548   0.234  1.00  0.00           C  
HETATM   13  C   UNL     1       3.613   0.697   0.471  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.018  -3.314   0.140  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.000   0.477   0.616  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.110   2.641  -0.728  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.753   2.638  -0.444  1.00  0.00           C  
HETATM   18  C   UNL     1       6.155   1.407  -0.359  1.00  0.00           C  
HETATM   19  C   UNL     1       0.628  -1.485   0.531  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.746   1.533   0.542  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.620   4.758  -1.506  1.00  0.00           C  
HETATM   22  C   UNL     1       8.500   1.264   0.007  1.00  0.00           C  
HETATM   23  C   UNL     1       2.229   0.310   0.923  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.968  -2.633   1.091  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.403  -0.700   1.345  1.00  0.00           C  
HETATM   26  N   UNL     1       1.836  -0.944   0.275  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.651  -1.533   0.398  1.00  0.00           N  
HETATM   28  O   UNL     1      -0.951   1.145  -0.291  1.00  0.00           O  
HETATM   29  O   UNL     1      -0.134  -0.933   1.300  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.311   1.949   1.747  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.975   3.684  -0.819  1.00  0.00           O  
HETATM   32  C   UNL     1      -3.527  -2.043  -0.665  1.00  0.00           C  
HETATM   33  O   UNL     1       7.404   1.755  -0.767  1.00  0.00           O  
HETATM   34  H   UNL     1       1.406  -5.063  -2.293  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.800  -6.045  -1.825  1.00  0.00           H  
HETATM   36  H   UNL     1       2.074  -2.956  -1.214  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.348  -4.931  -0.271  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.974  -0.329   0.625  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.957   1.584  -0.568  1.00  0.00           H  
HETATM   40  H   UNL     1       2.912   1.840  -1.194  1.00  0.00           H  
HETATM   41  H   UNL     1       5.172   2.470  -1.938  1.00  0.00           H  
HETATM   42  H   UNL     1       4.588  -0.366   2.049  1.00  0.00           H  
HETATM   43  H   UNL     1       6.851   0.264   1.314  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.550   3.478  -1.250  1.00  0.00           H  
HETATM   45  H   UNL     1       2.224   0.176   2.005  1.00  0.00           H  
HETATM   46  H   UNL     1       1.525   1.096   0.651  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.706  -3.353   1.445  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.410  -2.237   1.940  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.733  -0.341   2.126  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.201  -1.291   1.795  1.00  0.00           H  
HETATM   51  H   UNL     1       2.445  -1.384  -0.338  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.357   1.920   1.903  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.395   5.184  -0.868  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.887   5.527  -1.748  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.071   4.384  -2.424  1.00  0.00           H  
HETATM   56  H   UNL     1       8.414   1.628   1.031  1.00  0.00           H  
HETATM   57  H   UNL     1       8.485   0.174   0.007  1.00  0.00           H  
HETATM   58  H   UNL     1       9.436   1.615  -0.426  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.320  -2.646  -0.224  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.965  -1.206  -1.208  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.944  -2.657  -1.352  1.00  0.00           H  
CONECT    1    2    3    3   34                                       
CONECT    2    1    4    4   35                                       
CONECT    3    1    1   11   36                                       
CONECT    4    2    2   14   37                                       
CONECT    5    8   15   15   38                                       
CONECT    6    9   13   13   40                                       
CONECT    7   10   10   13   42                                       
CONECT    8    5   16   16   39                                       
CONECT    9    6   18   18   41                                       
CONECT   10    7    7   18   43                                       
CONECT   11    3   14   14   19                                       
CONECT   12   15   17   17   20                                       
CONECT   13    6    6    7   23                                       
CONECT   14    4   11   11   24                                       
CONECT   15    5    5   12   25                                       
CONECT   16    8    8   17   44                                       
CONECT   17   12   12   16   31                                       
CONECT   18    9    9   10   33                                       
CONECT   19   11   26   29   29                                       
CONECT   20   12   28   28   30                                       
CONECT   21   31   53   54   55                                       
CONECT   22   33   56   57   58                                       
CONECT   23   13   26   45   46                                       
CONECT   24   14   27   47   48                                       
CONECT   25   15   27   49   50                                       
CONECT   26   19   23   51                                            
CONECT   27   24   25   32                                            
CONECT   28   20   20                                                 
CONECT   29   19   19                                                 
CONECT   30   20   52                                                 
CONECT   31   17   21                                                 
CONECT   32   27   59   60   61                                       
CONECT   33   18   22                                                 
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    8                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42    7                                                      
CONECT   43   10                                                      
CONECT   44   16                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   30                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
