COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       5.205   0.363   0.822  1.00  0.00           C  
HETATM    2  O   UNL     1       3.975   0.472   0.058  1.00  0.00           O  
HETATM    3  C   UNL     1       2.828   0.566   0.755  1.00  0.00           C  
HETATM    4  O   UNL     1       2.852   0.557   1.970  1.00  0.00           O  
HETATM    5  C   UNL     1       6.376   0.268  -0.120  1.00  0.00           C  
HETATM    6  C   UNL     1       7.016   1.418  -0.546  1.00  0.00           C  
HETATM    7  C   UNL     1       8.090   1.331  -1.411  1.00  0.00           C  
HETATM    8  C   UNL     1       8.526   0.095  -1.850  1.00  0.00           C  
HETATM    9  C   UNL     1       7.887  -1.054  -1.424  1.00  0.00           C  
HETATM   10  C   UNL     1       6.816  -0.968  -0.555  1.00  0.00           C  
HETATM   11  N   UNL     1       1.651   0.670   0.106  1.00  0.00           N  
HETATM   12  C   UNL     1       0.395   0.662   0.860  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.707   0.110  -0.007  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.535  -0.017  -1.200  1.00  0.00           O  
HETATM   15  C   UNL     1       0.045   2.090   1.283  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.179   2.064   2.201  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.819   1.361   3.511  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.625   3.497   2.497  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.885  -0.244   0.545  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.919  -0.877  -0.278  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.365  -2.163  -0.893  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.361  -2.760  -1.725  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.340   0.082  -1.393  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.967   1.336  -0.779  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.289   0.983  -0.060  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.155   2.225  -0.367  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.611   2.784  -1.610  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.381   2.306  -1.863  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.701   2.609  -2.821  1.00  0.00           O  
HETATM   30  H   UNL     1       5.318   1.242   1.456  1.00  0.00           H  
HETATM   31  H   UNL     1       5.167  -0.531   1.445  1.00  0.00           H  
HETATM   32  H   UNL     1       6.675   2.384  -0.203  1.00  0.00           H  
HETATM   33  H   UNL     1       8.589   2.229  -1.744  1.00  0.00           H  
HETATM   34  H   UNL     1       9.366   0.028  -2.526  1.00  0.00           H  
HETATM   35  H   UNL     1       8.228  -2.020  -1.768  1.00  0.00           H  
HETATM   36  H   UNL     1       6.319  -1.866  -0.220  1.00  0.00           H  
HETATM   37  H   UNL     1       1.636   0.750  -0.861  1.00  0.00           H  
HETATM   38  H   UNL     1       0.508   0.038   1.746  1.00  0.00           H  
HETATM   39  H   UNL     1       0.889   2.529   1.815  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.177   2.687   0.398  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.990   1.526   1.710  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.437   0.363   3.295  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.056   1.936   4.035  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.708   1.282   4.137  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.881   3.999   1.563  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.497   3.479   3.151  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.814   4.036   2.987  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.048  -0.080   1.487  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.783  -1.114   0.343  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.484  -1.930  -1.491  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.653  -2.198  -2.455  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.466   0.363  -1.980  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.069  -0.409  -2.038  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.270   1.809  -0.086  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.735   0.083  -0.482  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.133   0.872   1.013  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.196   1.933  -0.508  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.073   2.951   0.441  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.080   3.417  -2.176  1.00  0.00           H  
HETATM   60  S   UNL     1      -1.910  -3.319   0.429  1.00  0.00           S  
HETATM   61  O   UNL     1      -3.024  -3.575   1.273  1.00  0.00           O  
HETATM   62  O   UNL     1      -1.121  -4.382  -0.087  1.00  0.00           O  
HETATM   63  O   UNL     1      -0.948  -2.531   1.308  1.00  0.00           O  
HETATM   64  H   UNL     1      -0.614  -3.026   2.068  1.00  0.00           H  
CONECT    1    2    5   30   31                                       
CONECT    2    3    1                                                 
CONECT    3   11    2    4    4                                       
CONECT    4    3    3                                                 
CONECT    5    1    6    6   10                                       
CONECT    6    5    5    7   32                                       
CONECT    7    6    8    8   33                                       
CONECT    8    7    7    9   34                                       
CONECT    9   10   10    8   35                                       
CONECT   10    5    9    9   36                                       
CONECT   11   12    3   37                                            
CONECT   12   15   11   13   38                                       
CONECT   13   12   14   14   19                                       
CONECT   14   13   13                                                 
CONECT   15   16   12   39   40                                       
CONECT   16   17   18   15   41                                       
CONECT   17   16   42   43   44                                       
CONECT   18   16   45   46   47                                       
CONECT   19   13   20   48                                            
CONECT   20   19   21   23   49                                       
CONECT   21   22   20   50   60                                       
CONECT   22   21   51                                                 
CONECT   23   20   24   52   53                                       
CONECT   24   23   25   28   54                                       
CONECT   25   24   26   55   56                                       
CONECT   26   25   27   57   58                                       
CONECT   27   28   26   59                                            
CONECT   28   24   29   29   27                                       
CONECT   29   28   28                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   21   61   61   62                                       
CONECT   60   62   63                                                 
CONECT   61   60   60                                                 
CONECT   62   60   60                                                 
CONECT   63   60   64                                                 
CONECT   64   63                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
