COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.185  -3.223  -0.468  1.00  0.00           C  
HETATM    2  C   UNL     1       5.522  -0.998  -1.360  1.00  0.00           C  
HETATM    3  C   UNL     1       5.370   0.493  -1.049  1.00  0.00           C  
HETATM    4  C   UNL     1       3.884   0.828  -0.893  1.00  0.00           C  
HETATM    5  C   UNL     1       3.498  -1.519  -0.133  1.00  0.00           C  
HETATM    6  C   UNL     1       1.968   2.737  -0.174  1.00  0.00           C  
HETATM    7  C   UNL     1       0.090   2.651   1.309  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.230   3.208  -0.997  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.223   1.727   0.430  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.216   0.201   0.325  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.512  -2.072  -0.055  1.00  0.00           C  
HETATM   12  C   UNL     1       4.926  -5.492   0.547  1.00  0.00           C  
HETATM   13  C   UNL     1       4.784  -3.989   0.795  1.00  0.00           C  
HETATM   14  C   UNL     1       5.695  -3.575   1.953  1.00  0.00           C  
HETATM   15  N   UNL     1       4.935  -1.789  -0.271  1.00  0.00           N  
HETATM   16  C   UNL     1       3.286  -0.044   0.215  1.00  0.00           C  
HETATM   17  S   UNL     1       3.701   2.578  -0.453  1.00  0.00           S  
HETATM   18  O   UNL     1       4.254   2.803   0.837  1.00  0.00           O  
HETATM   19  C   UNL     1       1.450   2.526   1.090  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.750   2.986   0.264  1.00  0.00           C  
HETATM   21  C   UNL     1       1.128   3.078  -1.217  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.231   3.128   0.505  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.889   1.840   0.274  1.00  0.00           N  
HETATM   24  O   UNL     1      -4.880   2.694   0.763  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.884   0.432   0.199  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.414  -1.209   0.006  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.302  -3.378  -0.405  1.00  0.00           C  
HETATM   28  N   UNL     1      -6.090  -3.826  -0.682  1.00  0.00           N  
HETATM   29  C   UNL     1      -5.021  -3.059  -0.639  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.133  -1.717  -0.294  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.257  -0.704  -0.171  1.00  0.00           O  
HETATM   32  H   UNL     1       6.244  -3.383  -0.669  1.00  0.00           H  
HETATM   33  H   UNL     1       4.596  -3.582  -1.312  1.00  0.00           H  
HETATM   34  H   UNL     1       5.008  -1.229  -2.293  1.00  0.00           H  
HETATM   35  H   UNL     1       6.580  -1.243  -1.457  1.00  0.00           H  
HETATM   36  H   UNL     1       5.895   0.726  -0.123  1.00  0.00           H  
HETATM   37  H   UNL     1       5.793   1.079  -1.865  1.00  0.00           H  
HETATM   38  H   UNL     1       3.366   0.631  -1.831  1.00  0.00           H  
HETATM   39  H   UNL     1       2.994  -1.747  -1.072  1.00  0.00           H  
HETATM   40  H   UNL     1       3.086  -2.142   0.661  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.315   2.485   2.297  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.887   3.471  -1.813  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.975   0.915   0.609  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.506  -1.715   0.170  1.00  0.00           H  
HETATM   45  H   UNL     1       5.961  -5.722   0.295  1.00  0.00           H  
HETATM   46  H   UNL     1       4.641  -6.037   1.446  1.00  0.00           H  
HETATM   47  H   UNL     1       4.277  -5.787  -0.278  1.00  0.00           H  
HETATM   48  H   UNL     1       3.749  -3.758   1.047  1.00  0.00           H  
HETATM   49  H   UNL     1       5.594  -2.504   2.129  1.00  0.00           H  
HETATM   50  H   UNL     1       5.410  -4.120   2.852  1.00  0.00           H  
HETATM   51  H   UNL     1       6.730  -3.805   1.701  1.00  0.00           H  
HETATM   52  H   UNL     1       3.778   0.181   1.161  1.00  0.00           H  
HETATM   53  H   UNL     1       2.219   0.160   0.302  1.00  0.00           H  
HETATM   54  H   UNL     1       2.106   2.263   1.907  1.00  0.00           H  
HETATM   55  H   UNL     1       1.534   3.243  -2.204  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.404   3.445   1.533  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.640   3.872  -0.178  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.364   1.068   0.009  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.142  -4.054  -0.456  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.052  -3.474  -0.874  1.00  0.00           H  
CONECT    1   15   13   32   33                                       
CONECT    2    3   15   34   35                                       
CONECT    3    4    2   36   37                                       
CONECT    4   17    3   16   38                                       
CONECT    5   16   15   39   40                                       
CONECT    6   21   21   19   17                                       
CONECT    7   20   19   19   41                                       
CONECT    8   20   20   21   42                                       
CONECT    9   25   23   24   24                                       
CONECT   10   26   25   25   43                                       
CONECT   11   27   26   26   44                                       
CONECT   12   13   45   46   47                                       
CONECT   13    1   12   14   48                                       
CONECT   14   13   49   50   51                                       
CONECT   15    2    5    1                                            
CONECT   16    4    5   52   53                                       
CONECT   17    6   18   18    4                                       
CONECT   18   17   17                                                 
CONECT   19    7    7    6   54                                       
CONECT   20   22    8    8    7                                       
CONECT   21    8    6    6   55                                       
CONECT   22   23   20   56   57                                       
CONECT   23    9   22   58                                            
CONECT   24    9    9                                                 
CONECT   25   10   10   31    9                                       
CONECT   26   11   11   30   10                                       
CONECT   27   28   28   11   59                                       
CONECT   28   27   27   29                                            
CONECT   29   28   30   30   60                                       
CONECT   30   29   29   26   31                                       
CONECT   31   30   25                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   19                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
