COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.075  -2.469   1.684  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.106  -4.506   1.251  1.00  0.00           C  
HETATM    3  C   UNL     1       3.476  -2.816  -1.181  1.00  0.00           C  
HETATM    4  C   UNL     1       1.892  -2.713   0.602  1.00  0.00           C  
HETATM    5  C   UNL     1       1.722  -3.860  -0.169  1.00  0.00           C  
HETATM    6  C   UNL     1       4.188  -1.761   0.988  1.00  0.00           C  
HETATM    7  C   UNL     1       3.844   1.648  -0.350  1.00  0.00           C  
HETATM    8  C   UNL     1       4.936   3.769  -0.277  1.00  0.00           C  
HETATM    9  C   UNL     1       3.815   4.406   0.545  1.00  0.00           C  
HETATM   10  C   UNL     1       0.711  -4.756   0.168  1.00  0.00           C  
HETATM   11  C   UNL     1       2.649  -0.557  -0.448  1.00  0.00           C  
HETATM   12  C   UNL     1       3.041  -1.973  -0.016  1.00  0.00           C  
HETATM   13  C   UNL     1       4.692   4.034  -1.764  1.00  0.00           C  
HETATM   14  C   UNL     1       6.279   4.375   0.134  1.00  0.00           C  
HETATM   15  C   UNL     1       1.441  -0.099   0.329  1.00  0.00           C  
HETATM   16  O   UNL     1       4.383  -2.578  -1.950  1.00  0.00           O  
HETATM   17  C   UNL     1       0.076  -3.367   2.014  1.00  0.00           C  
HETATM   18  N   UNL     1       2.663  -3.891  -1.202  1.00  0.00           N  
HETATM   19  N   UNL     1       3.798   0.316  -0.153  1.00  0.00           N  
HETATM   20  C   UNL     1       4.890  -0.511   0.395  1.00  0.00           C  
HETATM   21  O   UNL     1       2.880   2.228  -0.809  1.00  0.00           O  
HETATM   22  O   UNL     1       4.958   2.337  -0.038  1.00  0.00           O  
HETATM   23  C   UNL     1       1.588   0.364   1.624  1.00  0.00           C  
HETATM   24  C   UNL     1       0.484   0.786   2.342  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.771   0.748   1.770  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.925   0.283   0.465  1.00  0.00           C  
HETATM   27  C   UNL     1       0.192  -0.137  -0.256  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.272   0.239  -0.156  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.387   0.669   0.562  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.637   0.626  -0.021  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.785   0.159  -1.314  1.00  0.00           C  
HETATM   32  C   UNL     1      -3.682  -0.269  -2.031  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.426  -0.226  -1.460  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.153   0.114  -1.945  1.00  0.00           C  
HETATM   35  O   UNL     1      -6.068  -0.518  -3.223  1.00  0.00           O  
HETATM   36  S   UNL     1      -6.048   1.168   0.885  1.00  0.00           S  
HETATM   37  O   UNL     1      -6.991   0.116   0.727  1.00  0.00           O  
HETATM   38  O   UNL     1      -5.534   1.504   2.166  1.00  0.00           O  
HETATM   39  C   UNL     1      -6.603   2.657   0.011  1.00  0.00           C  
HETATM   40  H   UNL     1       1.217  -1.577   2.276  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.888  -5.205   1.507  1.00  0.00           H  
HETATM   42  H   UNL     1       3.800  -1.555   1.986  1.00  0.00           H  
HETATM   43  H   UNL     1       4.861  -2.618   1.001  1.00  0.00           H  
HETATM   44  H   UNL     1       2.858   3.974   0.252  1.00  0.00           H  
HETATM   45  H   UNL     1       3.989   4.218   1.605  1.00  0.00           H  
HETATM   46  H   UNL     1       3.799   5.482   0.366  1.00  0.00           H  
HETATM   47  H   UNL     1       0.563  -5.648  -0.423  1.00  0.00           H  
HETATM   48  H   UNL     1       2.433  -0.540  -1.516  1.00  0.00           H  
HETATM   49  H   UNL     1       4.675   5.109  -1.944  1.00  0.00           H  
HETATM   50  H   UNL     1       5.490   3.580  -2.351  1.00  0.00           H  
HETATM   51  H   UNL     1       3.735   3.602  -2.058  1.00  0.00           H  
HETATM   52  H   UNL     1       6.453   4.186   1.194  1.00  0.00           H  
HETATM   53  H   UNL     1       7.078   3.921  -0.452  1.00  0.00           H  
HETATM   54  H   UNL     1       6.263   5.450  -0.045  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.565  -3.175   2.862  1.00  0.00           H  
HETATM   56  H   UNL     1       2.723  -4.603  -1.858  1.00  0.00           H  
HETATM   57  H   UNL     1       5.421   0.032   1.177  1.00  0.00           H  
HETATM   58  H   UNL     1       5.578  -0.803  -0.398  1.00  0.00           H  
HETATM   59  H   UNL     1       2.569   0.396   2.076  1.00  0.00           H  
HETATM   60  H   UNL     1       0.605   1.146   3.353  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.632   1.078   2.332  1.00  0.00           H  
HETATM   62  H   UNL     1       0.078  -0.494  -1.268  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.273   1.033   1.572  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.803  -0.633  -3.040  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.564  -0.556  -2.022  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.830  -0.451  -1.304  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.530   1.130  -2.066  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.913  -0.582  -3.688  1.00  0.00           H  
HETATM   69  H   UNL     1      -6.959   2.384  -0.983  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.412   3.127   0.570  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.771   3.355  -0.081  1.00  0.00           H  
CONECT    1   17   17    4   40                                       
CONECT    2   10   10   17   41                                       
CONECT    3   18   16   16   12                                       
CONECT    4    5    5    1   12                                       
CONECT    5   10   18    4    4                                       
CONECT    6   12   20   42   43                                       
CONECT    7   19   22   21   21                                       
CONECT    8   13   22   14    9                                       
CONECT    9    8   44   45   46                                       
CONECT   10    2    2    5   47                                       
CONECT   11   12   15   19   48                                       
CONECT   12    4    3    6   11                                       
CONECT   13    8   49   50   51                                       
CONECT   14    8   52   53   54                                       
CONECT   15   23   11   27   27                                       
CONECT   16    3    3                                                 
CONECT   17    2    1    1   55                                       
CONECT   18    5    3   56                                            
CONECT   19   11   20    7                                            
CONECT   20    6   19   57   58                                       
CONECT   21    7    7                                                 
CONECT   22    7    8                                                 
CONECT   23   24   24   15   59                                       
CONECT   24   23   23   25   60                                       
CONECT   25   24   26   26   61                                       
CONECT   26   25   25   27   28                                       
CONECT   27   15   15   26   62                                       
CONECT   28   26   33   33   29                                       
CONECT   29   28   30   30   63                                       
CONECT   30   29   29   31   36                                       
CONECT   31   32   32   30   34                                       
CONECT   32   33   31   31   64                                       
CONECT   33   28   28   32   65                                       
CONECT   34   31   35   66   67                                       
CONECT   35   34   68                                                 
CONECT   36   38   38   30   39                                       
CONECT   36   37   37                                                 
CONECT   37   36   36                                                 
CONECT   38   36   36                                                 
CONECT   39   36   69   70   71                                       
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   20                                                      
CONECT   58   20                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   27                                                      
CONECT   63   29                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69   39                                                      
CONECT   70   39                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
