COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.486  -2.403   0.062  1.00  0.00           C  
HETATM    2  C   UNL     1       3.296   0.844   1.457  1.00  0.00           C  
HETATM    3  C   UNL     1       3.266   2.372   1.377  1.00  0.00           C  
HETATM    4  C   UNL     1       1.963   1.588   1.546  1.00  0.00           C  
HETATM    5  C   UNL     1       0.649  -1.852  -0.518  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.213  -0.590  -0.285  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.611   0.066  -1.435  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.691   1.446  -1.451  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.372   2.170  -0.317  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.458   3.674  -0.335  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.861   4.109   0.092  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.536  -2.597   1.437  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.949   5.637   0.075  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.974   1.513   0.832  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.900   0.133   0.850  1.00  0.00           C  
HETATM   16  C   UNL     1       0.543  -2.246   2.226  1.00  0.00           C  
HETATM   17  C   UNL     1       1.675  -1.702   1.650  1.00  0.00           C  
HETATM   18  C   UNL     1       1.730  -1.501   0.276  1.00  0.00           C  
HETATM   19  C   UNL     1       4.521  -0.621  -1.733  1.00  0.00           C  
HETATM   20  C   UNL     1       4.633   0.320  -0.684  1.00  0.00           C  
HETATM   21  C   UNL     1       5.670   1.357  -0.546  1.00  0.00           C  
HETATM   22  C   UNL     1       3.587   0.086   0.188  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.577  -2.757  -0.734  1.00  0.00           N  
HETATM   24  N   UNL     1       2.877  -0.944  -0.306  1.00  0.00           N  
HETATM   25  N   UNL     1       3.476  -1.365  -1.498  1.00  0.00           N  
HETATM   26  O   UNL     1      -3.233  -2.743   1.095  1.00  0.00           O  
HETATM   27  O   UNL     1       6.568   1.546  -1.533  1.00  0.00           O  
HETATM   28  O   UNL     1       5.717   2.040   0.457  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.981  -2.813  -1.289  1.00  0.00           O  
HETATM   30  S   UNL     1      -3.112  -2.349  -0.265  1.00  0.00           S  
HETATM   31  H   UNL     1       3.684   0.396   2.372  1.00  0.00           H  
HETATM   32  H   UNL     1       3.634   2.929   2.239  1.00  0.00           H  
HETATM   33  H   UNL     1       3.456   2.828   0.405  1.00  0.00           H  
HETATM   34  H   UNL     1       1.295   1.530   0.686  1.00  0.00           H  
HETATM   35  H   UNL     1       1.473   1.630   2.519  1.00  0.00           H  
HETATM   36  H   UNL     1       0.689  -1.696  -1.586  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.860  -0.500  -2.321  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.001   1.958  -2.350  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.723   4.088   0.355  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.256   4.038  -1.343  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.596   3.695  -0.598  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.063   3.746   1.100  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.420  -3.021   1.890  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.948   5.947   0.379  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.214   6.051   0.765  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.747   6.000  -0.933  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.725   2.079   1.718  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.590  -0.379   1.749  1.00  0.00           H  
HETATM   49  H   UNL     1       0.501  -2.397   3.294  1.00  0.00           H  
HETATM   50  H   UNL     1       2.517  -1.429   2.269  1.00  0.00           H  
HETATM   51  H   UNL     1       5.182  -0.706  -2.582  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.436  -3.242  -1.562  1.00  0.00           H  
HETATM   53  H   UNL     1       7.230   2.238  -1.397  1.00  0.00           H  
CONECT    1    5   23   12   12                                       
CONECT    2    3   22    4   31                                       
CONECT    3    2    4   32   33                                       
CONECT    4    3    2   34   35                                       
CONECT    5   18   18    1   36                                       
CONECT    6    7    7   15   30                                       
CONECT    7    8    6    6   37                                       
CONECT    8    9    9    7   38                                       
CONECT    9   10    8    8   14                                       
CONECT   10   11    9   39   40                                       
CONECT   11   13   10   41   42                                       
CONECT   12    1    1   16   43                                       
CONECT   13   11   44   45   46                                       
CONECT   14    9   15   15   47                                       
CONECT   15   14   14    6   48                                       
CONECT   16   17   17   12   49                                       
CONECT   17   18   16   16   50                                       
CONECT   18   24    5    5   17                                       
CONECT   19   20   25   25   51                                       
CONECT   20   21   19   22   22                                       
CONECT   21   28   28   27   20                                       
CONECT   22   20   20    2   24                                       
CONECT   23    1   30   52                                            
CONECT   24   22   25   18                                            
CONECT   25   19   19   24                                            
CONECT   26   30   30                                                 
CONECT   27   21   53                                                 
CONECT   28   21   21                                                 
CONECT   29   30   30                                                 
CONECT   30    6   23   26   26                                       
CONECT   30   29   29                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   13                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   23                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
