COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.500   2.321   0.179  1.00  0.00           C  
HETATM    2  C   UNL     1       6.771   0.786   1.273  1.00  0.00           C  
HETATM    3  C   UNL     1       8.773  -1.836  -0.171  1.00  0.00           C  
HETATM    4  C   UNL     1       6.806   1.031  -1.109  1.00  0.00           C  
HETATM    5  C   UNL     1       5.535   1.573  -1.072  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.299  -1.878  -0.256  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.552   0.687  -0.061  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.745  -4.506   0.922  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.742  -3.864  -0.467  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.665  -1.596  -0.243  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.095  -0.263  -0.123  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.165   0.762  -0.017  1.00  0.00           C  
HETATM   13  C   UNL     1       0.195   0.460  -0.031  1.00  0.00           C  
HETATM   14  C   UNL     1       1.194   1.541   0.081  1.00  0.00           C  
HETATM   15  C   UNL     1       4.886   1.731   0.139  1.00  0.00           C  
HETATM   16  C   UNL     1       5.502   1.333   1.311  1.00  0.00           C  
HETATM   17  C   UNL     1       7.424   0.637   0.063  1.00  0.00           C  
HETATM   18  C   UNL     1      10.122  -2.555  -0.225  1.00  0.00           C  
HETATM   19  C   UNL     1       0.614  -0.872  -0.146  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.570  -0.297  -0.142  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.887   0.330  -0.109  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.203   0.864  -0.204  1.00  0.00           C  
HETATM   23  C   UNL     1      -9.047   2.042  -0.695  1.00  0.00           C  
HETATM   24  C   UNL     1     -10.496   1.587  -0.881  1.00  0.00           C  
HETATM   25  C   UNL     1     -11.049   1.085   0.454  1.00  0.00           C  
HETATM   26  C   UNL     1     -10.205  -0.093   0.944  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.755   0.361   1.131  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.247  -1.007  -0.237  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.282  -1.987  -0.319  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.934  -1.645  -0.272  1.00  0.00           C  
HETATM   31  N   UNL     1      -2.778  -2.406  -0.331  1.00  0.00           N  
HETATM   32  N   UNL     1       2.509   1.248   0.068  1.00  0.00           N  
HETATM   33  O   UNL     1       9.587   0.238   1.297  1.00  0.00           O  
HETATM   34  O   UNL     1       9.622   0.490  -1.164  1.00  0.00           O  
HETATM   35  O   UNL     1       0.830   2.697   0.186  1.00  0.00           O  
HETATM   36  O   UNL     1      -6.849   1.288  -0.030  1.00  0.00           O  
HETATM   37  S   UNL     1       9.045  -0.052   0.016  1.00  0.00           S  
HETATM   38  H   UNL     1       3.358   2.851   1.122  1.00  0.00           H  
HETATM   39  H   UNL     1       3.377   3.017  -0.650  1.00  0.00           H  
HETATM   40  H   UNL     1       7.254   0.479   2.188  1.00  0.00           H  
HETATM   41  H   UNL     1       8.223  -2.025  -1.093  1.00  0.00           H  
HETATM   42  H   UNL     1       8.197  -2.207   0.678  1.00  0.00           H  
HETATM   43  H   UNL     1       7.317   0.916  -2.053  1.00  0.00           H  
HETATM   44  H   UNL     1       5.052   1.880  -1.987  1.00  0.00           H  
HETATM   45  H   UNL     1       0.037  -2.901  -0.348  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.272   1.725   0.040  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.718  -5.591   0.820  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.869  -4.172   1.478  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.649  -4.213   1.456  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.838  -4.157  -1.001  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.617  -4.199  -1.024  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.493   1.787   0.075  1.00  0.00           H  
HETATM   53  H   UNL     1       4.992   1.449   2.255  1.00  0.00           H  
HETATM   54  H   UNL     1       9.958  -3.627  -0.338  1.00  0.00           H  
HETATM   55  H   UNL     1      10.697  -2.185  -1.074  1.00  0.00           H  
HETATM   56  H   UNL     1      10.672  -2.366   0.697  1.00  0.00           H  
HETATM   57  H   UNL     1       1.669  -1.102  -0.157  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.240   0.059  -0.939  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.010   2.846   0.040  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.653   2.400  -1.646  1.00  0.00           H  
HETATM   61  H   UNL     1     -11.098   2.427  -1.231  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.533   0.783  -1.616  1.00  0.00           H  
HETATM   63  H   UNL     1     -11.012   1.889   1.188  1.00  0.00           H  
HETATM   64  H   UNL     1     -12.081   0.761   0.321  1.00  0.00           H  
HETATM   65  H   UNL     1     -10.598  -0.451   1.895  1.00  0.00           H  
HETATM   66  H   UNL     1     -10.241  -0.898   0.209  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.154  -0.478   1.480  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.718   1.165   1.865  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.292  -1.279  -0.274  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.572  -3.022  -0.419  1.00  0.00           H  
HETATM   71  H   UNL     1       2.800   0.326  -0.016  1.00  0.00           H  
CONECT    1   32   15   38   39                                       
CONECT    2   16   17   17   40                                       
CONECT    3   37   18   41   42                                       
CONECT    4    5    5   17   43                                       
CONECT    5   15    4    4   44                                       
CONECT    6   19   19   10   45                                       
CONECT    7   20   20   21   46                                       
CONECT    8    9   47   48   49                                       
CONECT    9   31    8   50   51                                       
CONECT   10   11   11    6   31                                       
CONECT   11   12   20   10   10                                       
CONECT   12   13   13   11   52                                       
CONECT   13   14   12   12   19                                       
CONECT   14   35   35   32   13                                       
CONECT   15    1   16   16    5                                       
CONECT   16   15   15    2   53                                       
CONECT   17    2    2    4   37                                       
CONECT   18    3   54   55   56                                       
CONECT   19   13    6    6   57                                       
CONECT   20    7    7   11   30                                       
CONECT   21   36    7   28   28                                       
CONECT   22   27   36   23   58                                       
CONECT   23   22   24   59   60                                       
CONECT   24   25   23   61   62                                       
CONECT   25   26   24   63   64                                       
CONECT   26   27   25   65   66                                       
CONECT   27   26   22   67   68                                       
CONECT   28   21   21   29   69                                       
CONECT   29   30   30   28   70                                       
CONECT   30   20   31   29   29                                       
CONECT   31   10   30    9                                            
CONECT   32    1   14   71                                            
CONECT   33   37   37                                                 
CONECT   34   37   37                                                 
CONECT   35   14   14                                                 
CONECT   36   21   22                                                 
CONECT   37   17   33   33    3                                       
CONECT   37   34   34                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52   12                                                      
CONECT   53   16                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   26                                                      
CONECT   67   27                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   32                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
