COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.405   1.743   1.603  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.448  -0.882   0.808  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.915  -0.450   0.756  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.184   0.788   0.552  1.00  0.00           C  
HETATM    5  N   UNL     1       0.108   0.407   0.598  1.00  0.00           N  
HETATM    6  C   UNL     1       1.163   1.411   0.756  1.00  0.00           C  
HETATM    7  C   UNL     1       1.474   2.052  -0.607  1.00  0.00           C  
HETATM    8  N   UNL     1       2.097  -1.328   0.011  1.00  0.00           N  
HETATM    9  C   UNL     1       2.822   2.800  -0.478  1.00  0.00           C  
HETATM   10  C   UNL     1       3.128   0.597  -1.112  1.00  0.00           C  
HETATM   11  C   UNL     1       3.003  -0.188   0.203  1.00  0.00           C  
HETATM   12  C   UNL     1       2.438   0.742   1.282  1.00  0.00           C  
HETATM   13  C   UNL     1       2.090  -2.199   1.193  1.00  0.00           C  
HETATM   14  C   UNL     1       1.031  -3.291   1.017  1.00  0.00           C  
HETATM   15  C   UNL     1       1.349  -4.106  -0.239  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.474   1.965   0.642  1.00  0.00           O  
HETATM   17  N   UNL     1      -2.154  -0.137   0.407  1.00  0.00           N  
HETATM   18  C   UNL     1      -3.558   0.277   0.357  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.923   0.672  -1.076  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.390   1.104  -1.128  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.280  -0.055  -0.677  1.00  0.00           C  
HETATM   22  O   UNL     1       3.821   1.829  -0.837  1.00  0.00           O  
HETATM   23  O   UNL     1       1.796   0.975  -1.522  1.00  0.00           O  
HETATM   24  C   UNL     1       2.446  -2.080  -1.201  1.00  0.00           C  
HETATM   25  C   UNL     1       1.398  -3.168  -1.448  1.00  0.00           C  
HETATM   26  H   UNL     1       3.114   2.368   2.281  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.188  -1.164   1.829  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.297  -1.735   0.147  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.549  -1.276   1.078  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.066   0.403   1.418  1.00  0.00           H  
HETATM   31  H   UNL     1       0.340  -0.532   0.527  1.00  0.00           H  
HETATM   32  H   UNL     1       0.835   2.180   1.456  1.00  0.00           H  
HETATM   33  H   UNL     1       0.668   2.695  -0.961  1.00  0.00           H  
HETATM   34  H   UNL     1       2.852   3.646  -1.165  1.00  0.00           H  
HETATM   35  H   UNL     1       2.971   3.139   0.547  1.00  0.00           H  
HETATM   36  H   UNL     1       3.634   0.021  -1.887  1.00  0.00           H  
HETATM   37  H   UNL     1       3.985  -0.549   0.507  1.00  0.00           H  
HETATM   38  H   UNL     1       2.203   0.163   2.175  1.00  0.00           H  
HETATM   39  H   UNL     1       3.070  -2.660   1.310  1.00  0.00           H  
HETATM   40  H   UNL     1       1.858  -1.608   2.079  1.00  0.00           H  
HETATM   41  H   UNL     1       1.037  -3.947   1.888  1.00  0.00           H  
HETATM   42  H   UNL     1       0.048  -2.831   0.914  1.00  0.00           H  
HETATM   43  H   UNL     1       2.315  -4.597  -0.120  1.00  0.00           H  
HETATM   44  H   UNL     1       0.574  -4.858  -0.391  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.922  -1.076   0.335  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.710   1.130   1.018  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.289   1.498  -1.398  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.772  -0.181  -1.737  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.541   1.957  -0.466  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.649   1.386  -2.148  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.128  -0.908  -1.338  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.324   0.252  -0.714  1.00  0.00           H  
HETATM   53  H   UNL     1       2.473  -1.402  -2.054  1.00  0.00           H  
HETATM   54  H   UNL     1       3.425  -2.542  -1.073  1.00  0.00           H  
HETATM   55  H   UNL     1       1.666  -3.736  -2.339  1.00  0.00           H  
HETATM   56  H   UNL     1       0.421  -2.706  -1.590  1.00  0.00           H  
CONECT    1   12   26                                                 
CONECT    2    3   18   27   28                                       
CONECT    3   21    2   29   30                                       
CONECT    4   17    5   16   16                                       
CONECT    5    4    6   31                                            
CONECT    6   12    5    7   32                                       
CONECT    7    6   23    9   33                                       
CONECT    8   24   13   11                                            
CONECT    9    7   22   34   35                                       
CONECT   10   11   23   22   36                                       
CONECT   11    8   12   10   37                                       
CONECT   12    1   11    6   38                                       
CONECT   13   14    8   39   40                                       
CONECT   14   15   13   41   42                                       
CONECT   15   25   14   43   44                                       
CONECT   16    4    4                                                 
CONECT   17   18    4   45                                            
CONECT   18    2   19   17   46                                       
CONECT   19   20   18   47   48                                       
CONECT   20   21   19   49   50                                       
CONECT   21    3   20   51   52                                       
CONECT   22   10    9                                                 
CONECT   23   10    7                                                 
CONECT   24   25    8   53   54                                       
CONECT   25   15   24   55   56                                       
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
