COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.342   1.760   0.681  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.555   2.289  -0.491  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.986   3.666  -0.143  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.188   4.203  -1.332  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.040   3.243  -1.652  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.503   1.210   0.389  1.00  0.00           C  
HETATM    7  C   UNL     1       1.328   0.093   1.592  1.00  0.00           C  
HETATM    8  C   UNL     1       2.760   0.437   1.184  1.00  0.00           C  
HETATM    9  C   UNL     1       3.125  -0.240  -0.111  1.00  0.00           C  
HETATM   10  C   UNL     1       2.186  -0.706  -1.002  1.00  0.00           C  
HETATM   11  C   UNL     1       2.592  -1.306  -2.185  1.00  0.00           C  
HETATM   12  C   UNL     1       4.883  -0.992  -1.583  1.00  0.00           C  
HETATM   13  C   UNL     1       6.785  -0.118   0.116  1.00  0.00           C  
HETATM   14  O   UNL     1       7.499  -0.309   2.417  1.00  0.00           O  
HETATM   15  C   UNL     1       0.704  -0.606  -0.737  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.855  -1.832   1.031  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.322  -1.748   0.873  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.387  -1.651   1.754  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.682  -1.589   1.263  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.918  -1.623  -0.099  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.862  -1.720  -0.992  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.562  -1.782  -0.516  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.233  -1.886  -1.154  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.402   2.442   1.141  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.021   0.719   1.203  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.610   1.866  -2.000  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.408   1.328  -0.810  1.00  0.00           C  
HETATM   28  O   UNL     1      -0.648   1.957   1.334  1.00  0.00           O  
HETATM   29  N   UNL     1       0.466   0.273   0.412  1.00  0.00           N  
HETATM   30  C   UNL     1       3.934  -1.450  -2.476  1.00  0.00           C  
HETATM   31  C   UNL     1       4.481  -0.387  -0.403  1.00  0.00           C  
HETATM   32  O   UNL     1       5.414   0.064   0.475  1.00  0.00           O  
HETATM   33  C   UNL     1       7.681   0.449   1.220  1.00  0.00           C  
HETATM   34  C   UNL     1       0.146  -1.999  -0.437  1.00  0.00           C  
HETATM   35  N   UNL     1      -1.295  -1.904  -0.190  1.00  0.00           N  
HETATM   36  O   UNL     1      -1.255  -1.831   2.087  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.023  -1.941  -2.349  1.00  0.00           O  
HETATM   38  H   UNL     1      -3.210   2.375  -1.358  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.804   4.350   0.085  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.332   3.580   0.725  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.842   4.289  -2.200  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.782   5.184  -1.085  1.00  0.00           H  
HETATM   43  H   UNL     1       0.528   3.625  -2.499  1.00  0.00           H  
HETATM   44  H   UNL     1       0.614   3.157  -0.784  1.00  0.00           H  
HETATM   45  H   UNL     1       1.279  -0.942   1.930  1.00  0.00           H  
HETATM   46  H   UNL     1       1.003   0.758   2.392  1.00  0.00           H  
HETATM   47  H   UNL     1       2.849   1.516   1.062  1.00  0.00           H  
HETATM   48  H   UNL     1       3.444   0.106   1.965  1.00  0.00           H  
HETATM   49  H   UNL     1       1.852  -1.665  -2.885  1.00  0.00           H  
HETATM   50  H   UNL     1       5.934  -1.104  -1.803  1.00  0.00           H  
HETATM   51  H   UNL     1       6.990  -1.181  -0.007  1.00  0.00           H  
HETATM   52  H   UNL     1       6.988   0.403  -0.820  1.00  0.00           H  
HETATM   53  H   UNL     1       8.038  -0.005   3.161  1.00  0.00           H  
HETATM   54  H   UNL     1       0.205  -0.198  -1.616  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.209  -1.625   2.819  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.513  -1.515   1.949  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.931  -1.574  -0.469  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.052  -1.746  -2.055  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.875   2.063   1.894  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.264   1.952  -2.867  1.00  0.00           H  
HETATM   61  H   UNL     1       0.208   1.181  -2.227  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.813   0.347  -1.058  1.00  0.00           H  
HETATM   63  H   UNL     1       4.241  -1.919  -3.399  1.00  0.00           H  
HETATM   64  H   UNL     1       8.723   0.391   0.907  1.00  0.00           H  
HETATM   65  H   UNL     1       7.414   1.490   1.405  1.00  0.00           H  
HETATM   66  H   UNL     1       0.326  -2.654  -1.289  1.00  0.00           H  
HETATM   67  H   UNL     1       0.640  -2.406   0.446  1.00  0.00           H  
CONECT    1   25   25    2   24                                       
CONECT    2    3    1   27   38                                       
CONECT    3    4    2   39   40                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4   26   43   44                                       
CONECT    6   28   28   27   29                                       
CONECT    7   29    8   45   46                                       
CONECT    8    7    9   47   48                                       
CONECT    9   10    8   31   31                                       
CONECT   10   15   11   11    9                                       
CONECT   11   10   10   30   49                                       
CONECT   12   30   30   31   50                                       
CONECT   13   32   33   51   52                                       
CONECT   14   33   53                                                 
CONECT   15   34   29   10   54                                       
CONECT   16   17   35   36   36                                       
CONECT   17   22   22   18   16                                       
CONECT   18   19   19   17   55                                       
CONECT   19   20   18   18   56                                       
CONECT   20   21   21   19   57                                       
CONECT   21   20   20   22   58                                       
CONECT   22   21   23   17   17                                       
CONECT   23   22   37   37   35                                       
CONECT   24    1   59                                                 
CONECT   25    1    1                                                 
CONECT   26    5   27   60   61                                       
CONECT   27    2    6   26   62                                       
CONECT   28    6    6                                                 
CONECT   29    6   15    7                                            
CONECT   30   11   12   12   63                                       
CONECT   31    9    9   12   32                                       
CONECT   32   31   13                                                 
CONECT   33   13   14   64   65                                       
CONECT   34   35   15   66   67                                       
CONECT   35   23   16   34                                            
CONECT   36   16   16                                                 
CONECT   37   23   23                                                 
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49   11                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   30                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
