COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.493  -3.740   0.544  1.00  0.00           C  
HETATM    2  C   UNL     1       3.735  -4.091   1.825  1.00  0.00           C  
HETATM    3  C   UNL     1       5.976  -4.072   0.721  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.133  -1.832   0.854  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.961  -0.565   0.056  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.777   0.012  -0.311  1.00  0.00           C  
HETATM    7  C   UNL     1       3.080  -1.734   0.057  1.00  0.00           C  
HETATM    8  C   UNL     1       3.926  -4.551  -0.623  1.00  0.00           C  
HETATM    9  C   UNL     1       5.456  -1.457   0.191  1.00  0.00           C  
HETATM   10  C   UNL     1       5.320  -0.105  -0.062  1.00  0.00           C  
HETATM   11  C   UNL     1       4.338  -2.269   0.256  1.00  0.00           C  
HETATM   12  C   UNL     1       4.027   5.012   2.329  1.00  0.00           C  
HETATM   13  C   UNL     1       4.357   3.671   1.670  1.00  0.00           C  
HETATM   14  C   UNL     1       4.779   3.907   0.218  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.815  -2.800  -0.776  1.00  0.00           C  
HETATM   16  C   UNL     1       0.568  -0.502   0.007  1.00  0.00           C  
HETATM   17  C   UNL     1      -9.186   0.494   0.485  1.00  0.00           C  
HETATM   18  C   UNL     1       2.935  -0.380  -0.208  1.00  0.00           C  
HETATM   19  C   UNL     1       4.062   0.438  -0.268  1.00  0.00           C  
HETATM   20  C   UNL     1       5.109   2.566  -0.441  1.00  0.00           C  
HETATM   21  C   UNL     1       5.649   2.811  -1.852  1.00  0.00           C  
HETATM   22  C   UNL     1       6.095   1.482  -2.464  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.327   0.005  -0.307  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.156   1.047   0.102  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.537   3.289   0.796  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.519   0.836   0.225  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.056  -0.410  -0.060  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.229  -1.447  -0.468  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.868  -1.240  -0.591  1.00  0.00           C  
HETATM   30  N   UNL     1       1.661   0.163  -0.415  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.945   0.216  -0.438  1.00  0.00           N  
HETATM   32  N   UNL     1      -2.321   1.279  -1.107  1.00  0.00           N  
HETATM   33  N   UNL     1      -1.046   1.127  -1.012  1.00  0.00           N  
HETATM   34  O   UNL     1       0.691  -1.526   0.651  1.00  0.00           O  
HETATM   35  O   UNL     1       3.926   1.768  -0.516  1.00  0.00           O  
HETATM   36  O   UNL     1      -4.628   2.268   0.382  1.00  0.00           O  
HETATM   37  O   UNL     1      -8.394  -0.617   0.060  1.00  0.00           O  
HETATM   38  H   UNL     1       3.847  -5.155   2.033  1.00  0.00           H  
HETATM   39  H   UNL     1       4.139  -3.514   2.657  1.00  0.00           H  
HETATM   40  H   UNL     1       2.678  -3.855   1.699  1.00  0.00           H  
HETATM   41  H   UNL     1       6.516  -3.821  -0.192  1.00  0.00           H  
HETATM   42  H   UNL     1       6.381  -3.494   1.553  1.00  0.00           H  
HETATM   43  H   UNL     1       6.088  -5.136   0.930  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.193  -2.683   0.175  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.282  -1.959   1.522  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.050  -1.770   1.440  1.00  0.00           H  
HETATM   47  H   UNL     1       2.209  -2.371   0.104  1.00  0.00           H  
HETATM   48  H   UNL     1       4.466  -4.300  -1.536  1.00  0.00           H  
HETATM   49  H   UNL     1       4.038  -5.615  -0.415  1.00  0.00           H  
HETATM   50  H   UNL     1       2.869  -4.314  -0.750  1.00  0.00           H  
HETATM   51  H   UNL     1       6.438  -1.879   0.351  1.00  0.00           H  
HETATM   52  H   UNL     1       6.194   0.528  -0.098  1.00  0.00           H  
HETATM   53  H   UNL     1       3.727   4.844   3.364  1.00  0.00           H  
HETATM   54  H   UNL     1       4.907   5.654   2.306  1.00  0.00           H  
HETATM   55  H   UNL     1       3.212   5.492   1.788  1.00  0.00           H  
HETATM   56  H   UNL     1       5.172   3.191   2.211  1.00  0.00           H  
HETATM   57  H   UNL     1       3.477   3.028   1.693  1.00  0.00           H  
HETATM   58  H   UNL     1       3.964   4.387  -0.323  1.00  0.00           H  
HETATM   59  H   UNL     1       5.659   4.549   0.195  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.088  -2.847  -1.830  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.078  -3.574  -0.557  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.702  -2.960  -0.163  1.00  0.00           H  
HETATM   63  H   UNL     1     -10.233   0.194   0.539  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.852   0.825   1.468  1.00  0.00           H  
HETATM   65  H   UNL     1      -9.079   1.311  -0.229  1.00  0.00           H  
HETATM   66  H   UNL     1       5.861   2.046   0.151  1.00  0.00           H  
HETATM   67  H   UNL     1       4.866   3.251  -2.469  1.00  0.00           H  
HETATM   68  H   UNL     1       6.498   3.491  -1.802  1.00  0.00           H  
HETATM   69  H   UNL     1       6.878   1.041  -1.847  1.00  0.00           H  
HETATM   70  H   UNL     1       5.246   0.801  -2.513  1.00  0.00           H  
HETATM   71  H   UNL     1       6.480   1.656  -3.469  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.987   4.210   0.987  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.273   3.461   0.010  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.046   2.974   1.707  1.00  0.00           H  
HETATM   75  H   UNL     1      -7.164   1.643   0.543  1.00  0.00           H  
HETATM   76  H   UNL     1      -4.227  -2.047  -0.913  1.00  0.00           H  
HETATM   77  H   UNL     1       1.566   1.018  -0.863  1.00  0.00           H  
CONECT    1    2    3    8   11                                       
CONECT    2    1   38   39   40                                       
CONECT    3    1   41   42   43                                       
CONECT    4    5   44   45   46                                       
CONECT    5    4   31    6    6                                       
CONECT    6    5    5   16   33                                       
CONECT    7   11   11   18   47                                       
CONECT    8    1   48   49   50                                       
CONECT    9   11   10   10   51                                       
CONECT   10    9    9   19   52                                       
CONECT   11    1    7    7    9                                       
CONECT   12   13   53   54   55                                       
CONECT   13   14   12   56   57                                       
CONECT   14   20   13   58   59                                       
CONECT   15   28   60   61   62                                       
CONECT   16   34   34    6   30                                       
CONECT   17   37   63   64   65                                       
CONECT   18    7   30   19   19                                       
CONECT   19   18   18   10   35                                       
CONECT   20   35   21   14   66                                       
CONECT   21   20   22   67   68                                       
CONECT   22   21   69   70   71                                       
CONECT   23   24   29   29   31                                       
CONECT   24   26   26   36   23                                       
CONECT   25   36   72   73   74                                       
CONECT   26   24   24   27   75                                       
CONECT   27   37   26   28   28                                       
CONECT   28   27   27   29   15                                       
CONECT   29   23   23   28   76                                       
CONECT   30   16   18   77                                            
CONECT   31    5   23   32                                            
CONECT   32   31   33   33                                            
CONECT   33    6   32   32                                            
CONECT   34   16   16                                                 
CONECT   35   19   20                                                 
CONECT   36   25   24                                                 
CONECT   37   17   27                                                 
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    4                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    8                                                      
CONECT   51    9                                                      
CONECT   52   10                                                      
CONECT   53   12                                                      
CONECT   54   12                                                      
CONECT   55   12                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   14                                                      
CONECT   59   14                                                      
CONECT   60   15                                                      
CONECT   61   15                                                      
CONECT   62   15                                                      
CONECT   63   17                                                      
CONECT   64   17                                                      
CONECT   65   17                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   21                                                      
CONECT   69   22                                                      
CONECT   70   22                                                      
CONECT   71   22                                                      
CONECT   72   25                                                      
CONECT   73   25                                                      
CONECT   74   25                                                      
CONECT   75   26                                                      
CONECT   76   29                                                      
CONECT   77   30                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
