COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.319   0.339  -0.815  1.00  0.00           C  
HETATM    2  O   UNL     1       4.210  -0.168  -0.027  1.00  0.00           O  
HETATM    3  C   UNL     1       2.987  -0.116  -0.588  1.00  0.00           C  
HETATM    4  O   UNL     1       2.850   0.342  -1.705  1.00  0.00           O  
HETATM    5  C   UNL     1       6.598   0.199  -0.030  1.00  0.00           C  
HETATM    6  C   UNL     1       7.352  -0.955  -0.137  1.00  0.00           C  
HETATM    7  C   UNL     1       8.525  -1.083   0.582  1.00  0.00           C  
HETATM    8  C   UNL     1       8.945  -0.058   1.409  1.00  0.00           C  
HETATM    9  C   UNL     1       8.191   1.097   1.515  1.00  0.00           C  
HETATM   10  C   UNL     1       7.020   1.227   0.792  1.00  0.00           C  
HETATM   11  N   UNL     1       1.914  -0.570   0.090  1.00  0.00           N  
HETATM   12  C   UNL     1       0.571  -0.413  -0.473  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.433  -0.306   0.645  1.00  0.00           C  
HETATM   14  O   UNL     1      -0.112  -0.594   1.779  1.00  0.00           O  
HETATM   15  C   UNL     1       0.238  -1.627  -1.343  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.066  -1.367  -2.102  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.854  -0.232  -3.106  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.483  -2.637  -2.847  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.688   0.111   0.386  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.625   0.345   1.488  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.299  -0.973   1.874  1.00  0.00           C  
HETATM   22  O   UNL     1      -4.295  -0.725   2.868  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.689   1.353   1.048  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.029   2.707   0.782  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.090   3.753   0.364  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.037   3.657  -1.177  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.691   3.164  -1.492  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.104   2.621  -0.412  1.00  0.00           C  
HETATM   29  O   UNL     1      -0.994   2.132  -0.396  1.00  0.00           O  
HETATM   30  S   UNL     1      -4.076  -1.706   0.409  1.00  0.00           S  
HETATM   31  O   UNL     1      -5.109  -0.862  -0.083  1.00  0.00           O  
HETATM   32  O   UNL     1      -3.090  -2.242  -0.463  1.00  0.00           O  
HETATM   33  O   UNL     1      -4.811  -2.928   0.940  1.00  0.00           O  
HETATM   34  H   UNL     1       5.397  -0.230  -1.741  1.00  0.00           H  
HETATM   35  H   UNL     1       5.148   1.390  -1.047  1.00  0.00           H  
HETATM   36  H   UNL     1       7.024  -1.756  -0.783  1.00  0.00           H  
HETATM   37  H   UNL     1       9.113  -1.985   0.499  1.00  0.00           H  
HETATM   38  H   UNL     1       9.861  -0.158   1.971  1.00  0.00           H  
HETATM   39  H   UNL     1       8.519   1.898   2.161  1.00  0.00           H  
HETATM   40  H   UNL     1       6.432   2.129   0.875  1.00  0.00           H  
HETATM   41  H   UNL     1       2.032  -1.002   0.951  1.00  0.00           H  
HETATM   42  H   UNL     1       0.536   0.491  -1.081  1.00  0.00           H  
HETATM   43  H   UNL     1       1.045  -1.796  -2.056  1.00  0.00           H  
HETATM   44  H   UNL     1       0.121  -2.506  -0.711  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.847  -1.087  -1.396  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.802   0.007  -3.588  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.480   0.649  -2.585  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.131  -0.544  -3.859  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.633  -3.445  -2.132  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.411  -2.452  -3.388  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.701  -2.917  -3.553  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.972   0.255  -0.530  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.083   0.742   2.347  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.552  -1.660   2.272  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.993  -0.120   2.583  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.170   0.998   0.137  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.435   1.460   1.835  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.484   3.045   1.663  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.076   3.478   0.738  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.809   4.750   0.703  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.790   2.955  -1.537  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.193   4.640  -1.621  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.278   3.222  -2.368  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.282  -3.430   0.261  1.00  0.00           H  
CONECT    1    2   34   35    5                                       
CONECT    2    3    1                                                 
CONECT    3   11    4    4    2                                       
CONECT    4    3    3                                                 
CONECT    5    1    6   10   10                                       
CONECT    6    5    7    7   36                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7    9    9   38                                       
CONECT    9    8    8   10   39                                       
CONECT   10    9    5    5   40                                       
CONECT   11   12    3   41                                            
CONECT   12   13   15   11   42                                       
CONECT   13   14   14   19   12                                       
CONECT   14   13   13                                                 
CONECT   15   12   16   43   44                                       
CONECT   16   15   17   18   45                                       
CONECT   17   16   46   47   48                                       
CONECT   18   16   49   50   51                                       
CONECT   19   20   13   52                                            
CONECT   20   21   23   19   53                                       
CONECT   21   22   20   54   30                                       
CONECT   22   21   55                                                 
CONECT   23   20   24   56   57                                       
CONECT   24   23   25   28   58                                       
CONECT   25   26   24   59   60                                       
CONECT   26   25   27   61   62                                       
CONECT   27   26   28   63                                            
CONECT   28   24   27   29   29                                       
CONECT   29   28   28                                                 
CONECT   30   21   31   31   32                                       
CONECT   30   32   33                                                 
CONECT   31   30   30                                                 
CONECT   32   30   30                                                 
CONECT   33   30   64                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   33                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
