COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -3.697  -1.969   0.181  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.932  -1.176  -0.280  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.642  -2.531  -0.444  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.247  -3.149  -0.637  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.377  -1.412  -0.355  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.219  -2.273   0.154  1.00  0.00           C  
HETATM    7  C   UNL     1       0.084  -1.821  -0.505  1.00  0.00           C  
HETATM    8  C   UNL     1       1.093  -2.973  -0.503  1.00  0.00           C  
HETATM    9  C   UNL     1       2.443  -2.455  -0.908  1.00  0.00           C  
HETATM   10  C   UNL     1       3.488  -2.400  -0.092  1.00  0.00           C  
HETATM   11  C   UNL     1       3.413  -2.836   1.269  1.00  0.00           C  
HETATM   12  C   UNL     1       4.803  -1.877  -0.619  1.00  0.00           C  
HETATM   13  C   UNL     1       4.992  -0.409  -0.225  1.00  0.00           C  
HETATM   14  C   UNL     1       6.318   0.086  -0.824  1.00  0.00           C  
HETATM   15  C   UNL     1       3.852   0.430  -0.790  1.00  0.00           C  
HETATM   16  C   UNL     1       3.375   1.490   0.208  1.00  0.00           C  
HETATM   17  C   UNL     1       2.905   0.798   1.494  1.00  0.00           C  
HETATM   18  C   UNL     1       2.175   2.212  -0.419  1.00  0.00           C  
HETATM   19  C   UNL     1       2.118   3.687  -0.094  1.00  0.00           C  
HETATM   20  C   UNL     1       2.660   4.059   1.281  1.00  0.00           C  
HETATM   21  C   UNL     1       0.767   4.323  -0.350  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.463   3.672   0.245  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.212   2.817   1.475  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.242   2.906  -0.822  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.568   2.378  -0.277  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.724   0.928  -0.667  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.322   0.650  -1.682  1.00  0.00           O  
HETATM   28  O   UNL     1      -2.205  -0.043   0.099  1.00  0.00           O  
HETATM   29  C   UNL     1      -5.529  -0.309   0.798  1.00  0.00           C  
HETATM   30  O   UNL     1      -5.033  -0.286   1.900  1.00  0.00           O  
HETATM   31  O   UNL     1      -6.613   0.438   0.535  1.00  0.00           O  
HETATM   32  O   UNL     1       5.870  -2.649  -0.058  1.00  0.00           O  
HETATM   33  O   UNL     1      -0.475   1.823  -1.341  1.00  0.00           O  
HETATM   34  N   UNL     1       3.353  -3.182   2.349  1.00  0.00           N  
HETATM   35  H   UNL     1      -3.673  -2.155   1.255  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.783  -0.643  -1.218  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.150  -2.870   0.458  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.272  -2.588  -1.332  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.912  -3.157  -1.673  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.126  -4.115  -0.145  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.388  -1.434  -1.445  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.138  -2.167   1.236  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.412  -3.317  -0.094  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.116  -1.522  -1.535  1.00  0.00           H  
HETATM   45  H   UNL     1       0.497  -0.976   0.044  1.00  0.00           H  
HETATM   46  H   UNL     1       1.105  -3.447   0.472  1.00  0.00           H  
HETATM   47  H   UNL     1       0.769  -3.718  -1.241  1.00  0.00           H  
HETATM   48  H   UNL     1       2.578  -2.103  -1.932  1.00  0.00           H  
HETATM   49  H   UNL     1       4.823  -1.967  -1.705  1.00  0.00           H  
HETATM   50  H   UNL     1       5.053  -0.333   0.856  1.00  0.00           H  
HETATM   51  H   UNL     1       6.283  -0.007  -1.910  1.00  0.00           H  
HETATM   52  H   UNL     1       6.471   1.132  -0.554  1.00  0.00           H  
HETATM   53  H   UNL     1       7.140  -0.513  -0.434  1.00  0.00           H  
HETATM   54  H   UNL     1       4.197   0.941  -1.696  1.00  0.00           H  
HETATM   55  H   UNL     1       3.016  -0.219  -1.056  1.00  0.00           H  
HETATM   56  H   UNL     1       4.181   2.179   0.418  1.00  0.00           H  
HETATM   57  H   UNL     1       3.733   0.236   1.927  1.00  0.00           H  
HETATM   58  H   UNL     1       2.565   1.549   2.207  1.00  0.00           H  
HETATM   59  H   UNL     1       2.085   0.119   1.263  1.00  0.00           H  
HETATM   60  H   UNL     1       2.263   2.099  -1.515  1.00  0.00           H  
HETATM   61  H   UNL     1       1.280   1.678  -0.119  1.00  0.00           H  
HETATM   62  H   UNL     1       2.823   4.176  -0.822  1.00  0.00           H  
HETATM   63  H   UNL     1       3.707   3.761   1.351  1.00  0.00           H  
HETATM   64  H   UNL     1       2.578   5.136   1.424  1.00  0.00           H  
HETATM   65  H   UNL     1       2.084   3.545   2.050  1.00  0.00           H  
HETATM   66  H   UNL     1       0.810   5.372   0.002  1.00  0.00           H  
HETATM   67  H   UNL     1       0.615   4.408  -1.442  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.136   4.503   0.573  1.00  0.00           H  
HETATM   69  H   UNL     1       0.325   3.403   2.221  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.165   2.488   1.889  1.00  0.00           H  
HETATM   71  H   UNL     1       0.383   1.948   1.198  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.463   3.599  -1.648  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.630   2.478   0.799  1.00  0.00           H  
HETATM   74  H   UNL     1      -3.386   2.950  -0.733  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.960   0.979   1.258  1.00  0.00           H  
HETATM   76  H   UNL     1       5.823  -3.593  -0.264  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.930   1.308  -2.022  1.00  0.00           H  
CONECT    1    5    4    2   35                                       
CONECT    2    1    3   29   36                                       
CONECT    3    4    2   37   38                                       
CONECT    4    1    3   39   40                                       
CONECT    5    6   28    1   41                                       
CONECT    6    7    5   42   43                                       
CONECT    7    8    6   44   45                                       
CONECT    8    9    7   46   47                                       
CONECT    9   10   10    8   48                                       
CONECT   10   12    9    9   11                                       
CONECT   11   10   34   34   34                                       
CONECT   12   32   13   10   49                                       
CONECT   13   14   12   15   50                                       
CONECT   14   13   51   52   53                                       
CONECT   15   13   16   54   55                                       
CONECT   16   15   17   18   56                                       
CONECT   17   16   57   58   59                                       
CONECT   18   16   19   60   61                                       
CONECT   19   20   18   21   62                                       
CONECT   20   19   63   64   65                                       
CONECT   21   19   22   66   67                                       
CONECT   22   24   21   23   68                                       
CONECT   23   22   69   70   71                                       
CONECT   24   33   22   25   72                                       
CONECT   25   24   26   73   74                                       
CONECT   26   27   27   28   25                                       
CONECT   27   26   26                                                 
CONECT   28    5   26                                                 
CONECT   29    2   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   75                                                 
CONECT   32   12   76                                                 
CONECT   33   24   77                                                 
CONECT   34   11   11   11                                            
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   17                                                      
CONECT   60   18                                                      
CONECT   61   18                                                      
CONECT   62   19                                                      
CONECT   63   20                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   21                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   23                                                      
CONECT   70   23                                                      
CONECT   71   23                                                      
CONECT   72   24                                                      
CONECT   73   25                                                      
CONECT   74   25                                                      
CONECT   75   31                                                      
CONECT   76   32                                                      
CONECT   77   33                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
