COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.307   1.110   0.135  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.013   1.788  -0.233  1.00  0.00           C  
HETATM    3  C   UNL     1       1.161   0.872   0.119  1.00  0.00           C  
HETATM    4  C   UNL     1       2.472   1.559  -0.254  1.00  0.00           C  
HETATM    5  C   UNL     1       2.523   1.816  -1.750  1.00  0.00           C  
HETATM    6  C   UNL     1       3.237   0.917  -2.655  1.00  0.00           C  
HETATM    7  C   UNL     1       3.955  -0.116  -2.193  1.00  0.00           C  
HETATM    8  C   UNL     1       3.976  -0.430  -0.767  1.00  0.00           C  
HETATM    9  C   UNL     1       3.706   0.792   0.142  1.00  0.00           C  
HETATM   10  C   UNL     1       3.735   0.157   1.536  1.00  0.00           C  
HETATM   11  C   UNL     1       5.017   0.087   2.360  1.00  0.00           C  
HETATM   12  C   UNL     1       4.746  -1.024   1.349  1.00  0.00           C  
HETATM   13  C   UNL     1       5.309  -0.886  -0.116  1.00  0.00           C  
HETATM   14  C   UNL     1       3.061  -1.602  -0.359  1.00  0.00           C  
HETATM   15  C   UNL     1       3.438  -1.822   1.139  1.00  0.00           C  
HETATM   16  O   UNL     1       2.746  -0.823   1.918  1.00  0.00           O  
HETATM   17  C   UNL     1       3.397  -3.266   1.642  1.00  0.00           C  
HETATM   18  C   UNL     1       2.499   2.935   0.456  1.00  0.00           C  
HETATM   19  O   UNL     1       1.954   2.794  -2.204  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.292   0.002   0.630  1.00  0.00           O  
HETATM   21  C   UNL     1      -5.416  -2.156  -0.670  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.145  -0.832  -0.089  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.936  -0.176  -0.364  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.689   1.074   0.189  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.641   1.670   1.011  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.839   1.018   1.282  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.096  -0.219   0.735  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.481   1.736  -0.081  1.00  0.00           N  
HETATM   29  O   UNL     1      -4.399   2.892   1.552  1.00  0.00           O  
HETATM   30  O   UNL     1      -3.010  -0.762  -1.166  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.579  -2.784  -0.404  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.591  -2.685  -1.389  1.00  0.00           O  
HETATM   33  O   UNL     1       3.391  -2.774  -1.123  1.00  0.00           O  
HETATM   34  H   UNL     1      -0.003   1.997  -1.303  1.00  0.00           H  
HETATM   35  H   UNL     1       0.078   2.723   0.320  1.00  0.00           H  
HETATM   36  H   UNL     1       1.152   0.664   1.189  1.00  0.00           H  
HETATM   37  H   UNL     1       1.071  -0.063  -0.435  1.00  0.00           H  
HETATM   38  H   UNL     1       3.186   1.088  -3.724  1.00  0.00           H  
HETATM   39  H   UNL     1       4.501  -0.743  -2.885  1.00  0.00           H  
HETATM   40  H   UNL     1       4.584   1.485   0.075  1.00  0.00           H  
HETATM   41  H   UNL     1       5.800   0.805   2.119  1.00  0.00           H  
HETATM   42  H   UNL     1       4.913  -0.159   3.417  1.00  0.00           H  
HETATM   43  H   UNL     1       5.646  -1.837  -0.520  1.00  0.00           H  
HETATM   44  H   UNL     1       6.070  -0.112  -0.191  1.00  0.00           H  
HETATM   45  H   UNL     1       2.009  -1.385  -0.483  1.00  0.00           H  
HETATM   46  H   UNL     1       3.570  -3.281   2.718  1.00  0.00           H  
HETATM   47  H   UNL     1       2.420  -3.698   1.426  1.00  0.00           H  
HETATM   48  H   UNL     1       4.170  -3.848   1.141  1.00  0.00           H  
HETATM   49  H   UNL     1       2.440   2.788   1.534  1.00  0.00           H  
HETATM   50  H   UNL     1       3.426   3.453   0.209  1.00  0.00           H  
HETATM   51  H   UNL     1       1.650   3.531   0.123  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.573   1.486   1.921  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.030  -0.718   0.945  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.491   2.643  -0.423  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.591   3.630   0.957  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.111  -0.547  -2.104  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.712  -3.652  -0.808  1.00  0.00           H  
HETATM   58  H   UNL     1       2.849  -3.547  -0.912  1.00  0.00           H  
CONECT    1   28   20   20    2                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3    9   18    5                                       
CONECT    5    4   19   19    6                                       
CONECT    6    5    7    7   38                                       
CONECT    7    6    6    8   39                                       
CONECT    8    7    9   13   14                                       
CONECT    9    4    8   10   40                                       
CONECT   10    9   11   16   12                                       
CONECT   11   10   12   41   42                                       
CONECT   12   10   11   15   13                                       
CONECT   13    8   12   43   44                                       
CONECT   14    8   15   33   45                                       
CONECT   15   12   14   16   17                                       
CONECT   16   10   15                                                 
CONECT   17   15   46   47   48                                       
CONECT   18    4   49   50   51                                       
CONECT   19    5    5                                                 
CONECT   20    1    1                                                 
CONECT   21   32   32   31   22                                       
CONECT   22   21   27   27   23                                       
CONECT   23   22   24   24   30                                       
CONECT   24   23   23   25   28                                       
CONECT   25   24   26   26   29                                       
CONECT   26   25   25   27   52                                       
CONECT   27   22   22   26   53                                       
CONECT   28    1   24   54                                            
CONECT   29   25   55                                                 
CONECT   30   23   56                                                 
CONECT   31   21   57                                                 
CONECT   32   21   21                                                 
CONECT   33   14   58                                                 
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
