COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.947   2.888  -0.544  1.00  0.00           C  
HETATM    2  C   UNL     1       2.247   4.320  -0.903  1.00  0.00           C  
HETATM    3  C   UNL     1       3.763   4.525  -0.957  1.00  0.00           C  
HETATM    4  C   UNL     1       1.640   4.641  -2.270  1.00  0.00           C  
HETATM    5  C   UNL     1       1.644   5.248   0.153  1.00  0.00           C  
HETATM    6  C   UNL     1       1.384   0.261   0.121  1.00  0.00           C  
HETATM    7  C   UNL     1       2.529  -1.955   2.626  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.215  -0.360   0.539  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.450   0.606   0.448  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.808   0.892   1.907  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.757   2.091   1.974  1.00  0.00           C  
HETATM   12  C   UNL     1       3.782  -2.711   3.072  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.558  -2.332  -0.780  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.637  -3.201  -0.837  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.856  -3.904  -2.012  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.999  -3.716  -3.079  1.00  0.00           C  
HETATM   17  C   UNL     1       0.257  -2.196  -1.888  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.031   1.777   1.188  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.673   1.491  -0.271  1.00  0.00           C  
HETATM   20  S   UNL     1       2.341  -2.104   0.828  1.00  0.00           S  
HETATM   21  O   UNL     1       3.471  -1.557   0.162  1.00  0.00           O  
HETATM   22  O   UNL     1       1.837  -3.387   0.484  1.00  0.00           O  
HETATM   23  N   UNL     1       1.105  -1.066   0.454  1.00  0.00           N  
HETATM   24  C   UNL     1       2.123   1.056   0.988  1.00  0.00           C  
HETATM   25  C   UNL     1       2.398   2.368   0.656  1.00  0.00           C  
HETATM   26  C   UNL     1       1.215   2.098  -1.412  1.00  0.00           C  
HETATM   27  C   UNL     1       0.933   0.786  -1.083  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.281  -1.541   0.473  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.773   0.753   0.731  1.00  0.00           O  
HETATM   30  N   UNL     1      -2.542  -0.541   0.384  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.725   0.292  -0.338  1.00  0.00           C  
HETATM   32  N   UNL     1       0.018  -2.881  -2.989  1.00  0.00           N  
HETATM   33  H   UNL     1       4.192   3.864  -1.709  1.00  0.00           H  
HETATM   34  H   UNL     1       3.980   5.561  -1.216  1.00  0.00           H  
HETATM   35  H   UNL     1       4.195   4.296   0.018  1.00  0.00           H  
HETATM   36  H   UNL     1       0.561   4.495  -2.232  1.00  0.00           H  
HETATM   37  H   UNL     1       1.858   5.677  -2.530  1.00  0.00           H  
HETATM   38  H   UNL     1       2.070   3.980  -3.023  1.00  0.00           H  
HETATM   39  H   UNL     1       2.076   5.019   1.127  1.00  0.00           H  
HETATM   40  H   UNL     1       1.862   6.284  -0.107  1.00  0.00           H  
HETATM   41  H   UNL     1       0.565   5.102   0.191  1.00  0.00           H  
HETATM   42  H   UNL     1       1.654  -2.379   3.119  1.00  0.00           H  
HETATM   43  H   UNL     1       2.624  -0.903   2.895  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.963   1.480   0.015  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.295   0.019   2.340  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.900   1.116   2.467  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.012   2.295   3.014  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.269   2.965   1.541  1.00  0.00           H  
HETATM   49  H   UNL     1       3.894  -2.622   4.153  1.00  0.00           H  
HETATM   50  H   UNL     1       3.687  -3.763   2.803  1.00  0.00           H  
HETATM   51  H   UNL     1       4.656  -2.287   2.579  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.290  -3.328   0.014  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.687  -4.589  -2.092  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.164  -4.259  -3.998  1.00  0.00           H  
HETATM   55  H   UNL     1       1.099  -1.521  -1.852  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.519   0.903   1.621  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.707   2.631   1.236  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.582   1.267  -0.831  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.186   2.364  -0.704  1.00  0.00           H  
HETATM   60  H   UNL     1       2.483   0.648   1.921  1.00  0.00           H  
HETATM   61  H   UNL     1       2.965   2.989   1.333  1.00  0.00           H  
HETATM   62  H   UNL     1       0.865   2.507  -2.348  1.00  0.00           H  
HETATM   63  H   UNL     1       0.362   0.170  -1.762  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.435  -2.176   1.345  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.895  -1.432   0.230  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.470   0.088  -1.378  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.212  -0.582   0.095  1.00  0.00           H  
CONECT    1   26    2   25   25                                       
CONECT    2    4    5    1    3                                       
CONECT    3    2   33   34   35                                       
CONECT    4    2   36   37   38                                       
CONECT    5    2   39   40   41                                       
CONECT    6   27   23   24   24                                       
CONECT    7   20   12   42   43                                       
CONECT    8   30   28   29   29                                       
CONECT    9   10   31   30   44                                       
CONECT   10   11    9   45   46                                       
CONECT   11   18   10   47   48                                       
CONECT   12    7   49   50   51                                       
CONECT   13   28   14   14   17                                       
CONECT   14   13   13   15   52                                       
CONECT   15   14   16   16   53                                       
CONECT   16   15   15   32   54                                       
CONECT   17   13   32   32   55                                       
CONECT   18   11   19   56   57                                       
CONECT   19   18   31   58   59                                       
CONECT   20   22   22   21   21                                       
CONECT   20   23    7                                                 
CONECT   21   20   20                                                 
CONECT   22   20   20                                                 
CONECT   23    6   20   28                                            
CONECT   24    6    6   25   60                                       
CONECT   25    1    1   24   61                                       
CONECT   26   27   27    1   62                                       
CONECT   27   26   26    6   63                                       
CONECT   28   23    8   13   64                                       
CONECT   29    8    8                                                 
CONECT   30    9    8   65                                            
CONECT   31   19    9   66   67                                       
CONECT   32   17   17   16                                            
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   12                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   18                                                      
CONECT   57   18                                                      
CONECT   58   19                                                      
CONECT   59   19                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   30                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
