COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.711   1.213   0.673  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.052   2.491  -0.096  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.747   2.125  -1.409  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.814   1.256  -2.254  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.472  -0.022  -1.486  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.778   0.343  -0.172  1.00  0.00           C  
HETATM    7  N   UNL     1      -5.450  -0.884   0.566  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.641  -1.724   0.748  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.367  -2.771   1.828  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.377  -1.630  -0.104  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.056  -0.951   0.151  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.349  -1.227   1.306  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.138  -0.603   1.541  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.550  -0.055  -0.772  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.339   0.568  -0.538  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.634   0.296   0.620  1.00  0.00           C  
HETATM   17  C   UNL     1       0.687   0.976   0.876  1.00  0.00           C  
HETATM   18  N   UNL     1       1.770   0.167   0.312  1.00  0.00           N  
HETATM   19  C   UNL     1       3.048   0.582   0.422  1.00  0.00           C  
HETATM   20  O   UNL     1       3.301   1.628   0.989  1.00  0.00           O  
HETATM   21  C   UNL     1       4.135  -0.230  -0.144  1.00  0.00           C  
HETATM   22  C   UNL     1       5.541   0.155  -0.064  1.00  0.00           C  
HETATM   23  C   UNL     1       6.156   1.299   0.523  1.00  0.00           C  
HETATM   24  O   UNL     1       5.484   2.155   1.072  1.00  0.00           O  
HETATM   25  N   UNL     1       7.498   1.416   0.458  1.00  0.00           N  
HETATM   26  C   UNL     1       8.239   0.459  -0.155  1.00  0.00           C  
HETATM   27  N   UNL     1       7.694  -0.591  -0.696  1.00  0.00           N  
HETATM   28  C   UNL     1       6.358  -0.786  -0.675  1.00  0.00           C  
HETATM   29  S   UNL     1       5.377  -2.095  -1.319  1.00  0.00           S  
HETATM   30  C   UNL     1       3.926  -1.393  -0.775  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.216   1.473   1.609  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.626   0.662   0.887  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.717   3.110   0.507  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.137   3.042  -0.310  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.663   1.574  -1.195  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.990   3.036  -1.957  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.309   0.995  -3.190  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.898   1.807  -2.469  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.388  -0.573  -1.271  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.808  -0.642  -2.088  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.862   0.894  -0.386  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.482  -1.100   1.051  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.880  -2.224  -0.191  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.236  -3.422   1.933  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.499  -3.367   1.545  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.171  -2.272   2.777  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.343  -2.648   0.286  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.569  -1.659  -1.177  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.743  -1.929   2.026  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.585  -0.818   2.444  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.100   0.157  -1.677  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.943   1.268  -1.259  1.00  0.00           H  
HETATM   53  H   UNL     1       0.685   1.960   0.406  1.00  0.00           H  
HETATM   54  H   UNL     1       0.836   1.087   1.950  1.00  0.00           H  
HETATM   55  H   UNL     1       1.568  -0.667  -0.140  1.00  0.00           H  
HETATM   56  H   UNL     1       9.312   0.572  -0.196  1.00  0.00           H  
HETATM   57  H   UNL     1       2.951  -1.832  -0.923  1.00  0.00           H  
HETATM   58  H   UNL     1       7.935   2.188   0.851  1.00  0.00           H  
CONECT    1    6    2   31   32                                       
CONECT    2    3    1   33   34                                       
CONECT    3    4    2   35   36                                       
CONECT    4    3    5   37   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    1    7    5   41                                       
CONECT    7    8    6   10                                            
CONECT    8    9    7   42   43                                       
CONECT    9    8   44   45   46                                       
CONECT   10    7   11   47   48                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   49                                       
CONECT   13   12   16   16   50                                       
CONECT   14   11   15   15   51                                       
CONECT   15   14   14   16   52                                       
CONECT   16   13   13   15   17                                       
CONECT   17   16   18   53   54                                       
CONECT   18   17   19   55                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   30   30                                       
CONECT   22   23   21   28   28                                       
CONECT   23   24   24   22   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   58                                            
CONECT   26   25   27   27   56                                       
CONECT   27   28   26   26                                            
CONECT   28   22   22   29   27                                       
CONECT   29   30   28                                                 
CONECT   30   21   21   29   57                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   17                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   26                                                      
CONECT   57   30                                                      
CONECT   58   25                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
