COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.023  -2.119  -1.644  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.005  -3.329  -1.668  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.325  -1.986  -2.359  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.062  -3.224   2.016  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.119  -1.117  -1.932  1.00  0.00           C  
HETATM    6  C   UNL     1       1.664  -0.691   0.321  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.755  -0.683   0.612  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.966  -0.896   2.112  1.00  0.00           C  
HETATM    9  C   UNL     1       0.111  -1.842   2.649  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.023  -1.957   4.169  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.884   0.148   0.060  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.260   0.559  -0.289  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.661   1.501   0.848  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.457  -0.315  -0.673  1.00  0.00           C  
HETATM   15  C   UNL     1       4.029  -0.873   0.054  1.00  0.00           C  
HETATM   16  C   UNL     1       5.248   0.021  -0.180  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.220   0.741   1.921  1.00  0.00           O  
HETATM   18  O   UNL     1       1.645  -1.900   0.442  1.00  0.00           O  
HETATM   19  N   UNL     1       0.516   0.011   0.391  1.00  0.00           N  
HETATM   20  N   UNL     1      -3.154  -0.295   0.150  1.00  0.00           N  
HETATM   21  N   UNL     1      -4.547  -3.349  -1.506  1.00  0.00           N  
HETATM   22  O   UNL     1      -2.844  -1.852  -1.555  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.650   1.215  -0.467  1.00  0.00           O  
HETATM   24  O   UNL     1       2.832  -0.053   0.118  1.00  0.00           O  
HETATM   25  S   UNL     1      -5.891   2.689   0.243  1.00  0.00           S  
HETATM   26  C   UNL     1       5.078   0.780  -1.498  1.00  0.00           C  
HETATM   27  C   UNL     1       5.376   1.021   0.971  1.00  0.00           C  
HETATM   28  S   UNL     1       6.743  -1.003  -0.261  1.00  0.00           S  
HETATM   29  C   UNL     1       8.028   0.186  -0.464  1.00  0.00           C  
HETATM   30  C   UNL     1       7.716   1.536  -0.572  1.00  0.00           C  
HETATM   31  C   UNL     1       8.726   2.464  -0.731  1.00  0.00           C  
HETATM   32  C   UNL     1      10.045   2.053  -0.783  1.00  0.00           C  
HETATM   33  C   UNL     1      10.358   0.710  -0.675  1.00  0.00           C  
HETATM   34  C   UNL     1       9.355  -0.224  -0.510  1.00  0.00           C  
HETATM   35  H   UNL     1      -6.493  -3.379  -0.695  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.328  -4.162  -2.293  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.358  -2.102  -3.442  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.260  -1.568  -1.986  1.00  0.00           H  
HETATM   39  H   UNL     1       0.033  -3.142   0.933  1.00  0.00           H  
HETATM   40  H   UNL     1       0.705  -3.898   2.398  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.048  -3.617   2.265  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.823  -0.449  -2.741  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.734  -1.649   0.107  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.898   0.061   2.628  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.950  -1.332   2.283  1.00  0.00           H  
HETATM   46  H   UNL     1       1.097  -1.449   2.400  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.009  -2.350   4.418  1.00  0.00           H  
HETATM   48  H   UNL     1       0.744  -2.631   4.551  1.00  0.00           H  
HETATM   49  H   UNL     1       0.100  -0.973   4.620  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.946   1.145  -1.153  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.781   2.037   1.202  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.322   0.319  -0.867  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.684  -0.999   0.144  1.00  0.00           H  
HETATM   54  H   UNL     1       3.938  -1.585  -0.766  1.00  0.00           H  
HETATM   55  H   UNL     1       4.150  -1.413   0.993  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.616   0.084   2.294  1.00  0.00           H  
HETATM   57  H   UNL     1       0.531   0.976   0.295  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.335  -1.178   0.507  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.027  -4.148  -1.323  1.00  0.00           H  
HETATM   60  H   UNL     1       4.432   1.643  -1.339  1.00  0.00           H  
HETATM   61  H   UNL     1       6.053   1.116  -1.852  1.00  0.00           H  
HETATM   62  H   UNL     1       4.629   0.122  -2.241  1.00  0.00           H  
HETATM   63  H   UNL     1       5.334   0.488   1.921  1.00  0.00           H  
HETATM   64  H   UNL     1       6.327   1.548   0.891  1.00  0.00           H  
HETATM   65  H   UNL     1       4.557   1.739   0.921  1.00  0.00           H  
HETATM   66  H   UNL     1       6.686   1.858  -0.533  1.00  0.00           H  
HETATM   67  H   UNL     1       8.485   3.514  -0.816  1.00  0.00           H  
HETATM   68  H   UNL     1      10.832   2.781  -0.907  1.00  0.00           H  
HETATM   69  H   UNL     1      11.390   0.392  -0.716  1.00  0.00           H  
HETATM   70  H   UNL     1       9.601  -1.272  -0.421  1.00  0.00           H  
HETATM   71  O   UNL     1      -5.248   3.306  -0.991  1.00  0.00           O  
HETATM   72  O   UNL     1      -7.034   2.011  -0.259  1.00  0.00           O  
HETATM   73  O   UNL     1      -6.023   3.775   1.150  1.00  0.00           O  
HETATM   74  H   UNL     1      -5.797   3.971  -1.429  1.00  0.00           H  
CONECT    1   22   22   21    5                                       
CONECT    2   21    3   35   36                                       
CONECT    3    5    2   37   38                                       
CONECT    4    9   39   40   41                                       
CONECT    5    1   14    3   42                                       
CONECT    6   18   18   24   19                                       
CONECT    7   19   11    8   43                                       
CONECT    8    7    9   44   45                                       
CONECT    9   10    8    4   46                                       
CONECT   10    9   47   48   49                                       
CONECT   11   20    7   23   23                                       
CONECT   12   14   20   13   50                                       
CONECT   13   25   12   17   51                                       
CONECT   14    5   12   52   53                                       
CONECT   15   16   24   54   55                                       
CONECT   16   28   15   27   26                                       
CONECT   17   13   56                                                 
CONECT   18    6    6                                                 
CONECT   19    6    7   57                                            
CONECT   20   12   11   58                                            
CONECT   21    1    2   59                                            
CONECT   22    1    1                                                 
CONECT   23   11   11                                                 
CONECT   24   15    6                                                 
CONECT   25   13   71   72   72                                       
CONECT   25   73   73                                                 
CONECT   26   16   60   61   62                                       
CONECT   27   16   63   64   65                                       
CONECT   28   29   16                                                 
CONECT   29   30   28   34   34                                       
CONECT   30   31   31   29   66                                       
CONECT   31   30   30   32   67                                       
CONECT   32   31   33   33   68                                       
CONECT   33   32   32   34   69                                       
CONECT   34   29   29   33   70                                       
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   17                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
CONECT   69   33                                                      
CONECT   70   34                                                      
CONECT   71   25   74                                                 
CONECT   72   25   25                                                 
CONECT   73   25   25                                                 
CONECT   74   71                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
