COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1       5.448   2.891   0.260  1.00  0.00           C  
HETATM    2  C   UNK A   1       2.867   3.250  -0.751  1.00  0.00           C  
HETATM    3  C   UNK A   0      -4.385  -3.000  -0.440  1.00  0.00           C  
HETATM    4  C   UNK A   1       4.720   1.797  -0.183  1.00  0.00           C  
HETATM    5  C   UNK A   1       3.417   1.979  -0.693  1.00  0.00           C  
HETATM    6  C   UNK A   1       4.888   4.161   0.204  1.00  0.00           C  
HETATM    7  C   UNK A   1       3.599   4.339  -0.295  1.00  0.00           C  
HETATM    8  C   UNK A   0      -3.530  -2.060   0.011  1.00  0.00           C  
HETATM    9  C   UNK A   0      -2.032  -3.726  -0.044  1.00  0.00           C  
HETATM   10  C   UNK A   1       4.987   0.348  -0.265  1.00  0.00           C  
HETATM   11  C   UNK A   1       2.939   0.633  -1.067  1.00  0.00           C  
HETATM   12  C   UNK A   1      -0.178   1.680   0.417  1.00  0.00           C  
HETATM   13  C   UNK A   0      -3.949  -0.665   0.264  1.00  0.00           C  
HETATM   14  C   UNK A   1       2.911  -2.119   1.254  1.00  0.00           C  
HETATM   15  C   UNK A   0      -2.997   0.296   0.870  1.00  0.00           C  
HETATM   16  C   UNK A   1       4.028  -2.864   1.864  1.00  0.00           C  
HETATM   17  C   UNK A   1       3.568  -1.954  -2.491  1.00  0.00           C  
HETATM   18  C   UNK A   0      -7.149   2.830  -0.097  1.00  0.00           C  
HETATM   19  C   UNK A   0      -7.823   0.546   0.594  1.00  0.00           C  
HETATM   20  C   UNK A   0      -7.080   0.984  -1.751  1.00  0.00           C  
HETATM   21  C   UNK A   1       2.624  -2.262  -0.218  1.00  0.00           C  
HETATM   22  C   UNK A   1       0.380   0.190   2.319  1.00  0.00           C  
HETATM   23  C   UNK A   1      -0.749   0.913   1.581  1.00  0.00           C  
HETATM   24  C   UNK A   1       3.798  -1.701  -1.023  1.00  0.00           C  
HETATM   25  C   UNK A   0      -6.870   1.361  -0.283  1.00  0.00           C  
HETATM   26  N   UNK A   0      -2.281  -2.480   0.212  1.00  0.00           N  
HETATM   27  N   UNK A   0      -5.154  -0.280  -0.046  1.00  0.00           N  
HETATM   28  N   UNK A   1       2.177  -1.343   1.983  1.00  0.00           N  
HETATM   29  N   UNK A   1       3.907  -0.259  -0.788  1.00  0.00           N  
HETATM   30  N   UNK A   0      -0.801  -4.342   0.104  1.00  0.00           N  
HETATM   31  N   UNK A   1      -1.718  -0.070   1.089  1.00  0.00           N  
HETATM   32  O   UNK A   1       4.284  -2.736   3.181  1.00  0.00           O  
HETATM   33  O   UNK A   1       3.437  -3.211  -2.942  1.00  0.00           O  
HETATM   34  O   UNK A   0      -8.362   3.326  -0.389  1.00  0.00           O  
HETATM   35  O   UNK A   1       6.012  -0.205   0.082  1.00  0.00           O  
HETATM   36  O   UNK A   1       1.853   0.374  -1.545  1.00  0.00           O  
HETATM   37  O   UNK A   1      -0.543   1.432  -0.707  1.00  0.00           O  
HETATM   38  O   UNK A   0      -3.369   1.413   1.169  1.00  0.00           O  
HETATM   39  O   UNK A   1       4.717  -3.593   1.179  1.00  0.00           O  
HETATM   40  O   UNK A   1       3.501  -1.026  -3.261  1.00  0.00           O  
HETATM   41  O   UNK A   0      -6.281   3.563   0.314  1.00  0.00           O  
HETATM   42  O   UNK A   1       5.599   5.233   0.638  1.00  0.00           O  
HETATM   43  O   UNK A   1       3.060   5.585  -0.346  1.00  0.00           O  
HETATM   44  O   UNK A   1       1.104  -0.627   1.398  1.00  0.00           O  
HETATM   45  O   UNK A   0      -5.520   1.081   0.092  1.00  0.00           O  
HETATM   46  S   UNK A   0      -3.501  -4.515  -0.608  1.00  0.00           S  
HETATM   47  H   UNK A   1       6.446   2.755   0.652  1.00  0.00           H  
HETATM   48  H   UNK A   1       1.870   3.392  -1.140  1.00  0.00           H  
HETATM   49  H   UNK A   0      -5.432  -2.851  -0.656  1.00  0.00           H  
HETATM   50  H   UNK A   1       0.558   2.452   0.588  1.00  0.00           H  
HETATM   51  H   UNK A   0      -7.621  -0.516   0.459  1.00  0.00           H  
HETATM   52  H   UNK A   0      -7.673   0.815   1.640  1.00  0.00           H  
HETATM   53  H   UNK A   0      -8.853   0.760   0.308  1.00  0.00           H  
HETATM   54  H   UNK A   0      -8.110   1.197  -2.037  1.00  0.00           H  
HETATM   55  H   UNK A   0      -6.401   1.565  -2.376  1.00  0.00           H  
HETATM   56  H   UNK A   0      -6.878  -0.079  -1.886  1.00  0.00           H  
HETATM   57  H   UNK A   1       2.488  -3.316  -0.461  1.00  0.00           H  
HETATM   58  H   UNK A   1       1.717  -1.711  -0.467  1.00  0.00           H  
HETATM   59  H   UNK A   1       1.053   0.925   2.760  1.00  0.00           H  
HETATM   60  H   UNK A   1      -0.042  -0.435   3.106  1.00  0.00           H  
HETATM   61  H   UNK A   1      -1.246   1.603   2.263  1.00  0.00           H  
HETATM   62  H   UNK A   1       4.720  -2.190  -0.710  1.00  0.00           H  
HETATM   63  H   UNK A   0      -0.039  -3.832   0.422  1.00  0.00           H  
HETATM   64  H   UNK A   0      -0.700  -5.282  -0.111  1.00  0.00           H  
HETATM   65  H   UNK A   1      -1.440  -0.984   0.922  1.00  0.00           H  
HETATM   66  H   UNK A   1       5.026  -3.244   3.535  1.00  0.00           H  
HETATM   67  H   UNK A   1       3.291  -3.324  -3.891  1.00  0.00           H  
HETATM   68  H   UNK A   0      -8.493   4.274  -0.254  1.00  0.00           H  
HETATM   69  H   UNK A   1       6.135   5.653  -0.049  1.00  0.00           H  
HETATM   70  H   UNK A   1       3.234   6.055  -1.173  1.00  0.00           H  
CONECT    1    6    6    4   47                                       
CONECT    2    7    7    5   48                                       
CONECT    3    8    8   46   49                                       
CONECT    4    1   10    5    5                                       
CONECT    5    4    4    2   11                                       
CONECT    6   42    1    1    7                                       
CONECT    7    6   43    2    2                                       
CONECT    8   13    3    3   26                                       
CONECT    9   26   26   46   30                                       
CONECT   10   35   35    4   29                                       
CONECT   11    5   29   36   36                                       
CONECT   12   23   37   37   50                                       
CONECT   13   15   27   27    8                                       
CONECT   14   16   21   28   28                                       
CONECT   15   31   38   38   13                                       
CONECT   16   39   39   32   14                                       
CONECT   17   40   40   24   33                                       
CONECT   18   25   41   41   34                                       
CONECT   19   25   51   52   53                                       
CONECT   20   25   54   55   56                                       
CONECT   21   24   14   57   58                                       
CONECT   22   44   23   59   60                                       
CONECT   23   22   12   31   61                                       
CONECT   24   29   17   21   62                                       
CONECT   25   19   20   45   18                                       
CONECT   26    8    9    9                                            
CONECT   27   45   13   13                                            
CONECT   28   14   14   44                                            
CONECT   29   10   11   24                                            
CONECT   30    9   63   64                                            
CONECT   31   23   15   65                                            
CONECT   32   16   66                                                 
CONECT   33   17   67                                                 
CONECT   34   18   68                                                 
CONECT   35   10   10                                                 
CONECT   36   11   11                                                 
CONECT   37   12   12                                                 
CONECT   38   15   15                                                 
CONECT   39   16   16                                                 
CONECT   40   17   17                                                 
CONECT   41   18   18                                                 
CONECT   42    6   69                                                 
CONECT   43    7   70                                                 
CONECT   44   28   22                                                 
CONECT   45   25   27                                                 
CONECT   46    3    9                                                 
CONECT   47    1                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50   12                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   42                                                      
CONECT   70   43                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
