COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.618   0.347   0.223  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.776  -0.445  -0.200  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.999  -0.961  -1.433  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.328   3.296  -0.357  1.00  0.00           O  
HETATM    5  C   UNL     1      -0.360   0.815  -0.166  1.00  0.00           C  
HETATM    6  C   UNL     1       0.943  -1.253  -0.514  1.00  0.00           C  
HETATM    7  C   UNL     1       2.081  -1.699   0.410  1.00  0.00           C  
HETATM    8  C   UNL     1       3.365  -0.961   0.025  1.00  0.00           C  
HETATM    9  C   UNL     1       4.511  -1.430   0.923  1.00  0.00           C  
HETATM   10  C   UNL     1       5.800  -0.796   0.465  1.00  0.00           C  
HETATM   11  C   UNL     1       6.583  -1.429  -0.481  1.00  0.00           C  
HETATM   12  C   UNL     1       7.765  -0.847  -0.901  1.00  0.00           C  
HETATM   13  C   UNL     1       8.163   0.367  -0.375  1.00  0.00           C  
HETATM   14  C   UNL     1       9.451   1.001  -0.832  1.00  0.00           C  
HETATM   15  C   UNL     1       3.162   0.545   0.202  1.00  0.00           C  
HETATM   16  C   UNL     1       2.037   1.017  -0.724  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.823   2.206  -0.138  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.157   1.710   0.268  1.00  0.00           C  
HETATM   19  O   UNL     1      -3.233   2.214   0.526  1.00  0.00           O  
HETATM   20  N   UNL     1      -2.143  -0.898   0.462  1.00  0.00           N  
HETATM   21  S   UNL     1      -3.685  -1.047   1.046  1.00  0.00           S  
HETATM   22  O   UNL     1      -3.790  -0.146   2.140  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.938  -2.441   1.161  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.615   0.691  -0.148  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.765   1.650   1.005  1.00  0.00           C  
HETATM   26  N   UNL     1      -6.234   0.744  -1.292  1.00  0.00           N  
HETATM   27  O   UNL     1      -5.905  -0.165  -2.019  1.00  0.00           O  
HETATM   28  C   UNL     1      -4.357  -2.188  -2.028  1.00  0.00           C  
HETATM   29  N   UNL     1       0.837   0.212  -0.460  1.00  0.00           N  
HETATM   30  C   UNL     1       6.195   0.421   0.988  1.00  0.00           C  
HETATM   31  C   UNL     1       7.379   1.000   0.572  1.00  0.00           C  
HETATM   32  H   UNL     1       1.158  -1.566  -1.536  1.00  0.00           H  
HETATM   33  H   UNL     1       0.007  -1.702  -0.184  1.00  0.00           H  
HETATM   34  H   UNL     1       1.823  -1.466   1.443  1.00  0.00           H  
HETATM   35  H   UNL     1       2.234  -2.773   0.306  1.00  0.00           H  
HETATM   36  H   UNL     1       3.609  -1.175  -1.016  1.00  0.00           H  
HETATM   37  H   UNL     1       4.309  -1.138   1.953  1.00  0.00           H  
HETATM   38  H   UNL     1       4.599  -2.515   0.864  1.00  0.00           H  
HETATM   39  H   UNL     1       6.272  -2.378  -0.893  1.00  0.00           H  
HETATM   40  H   UNL     1       8.377  -1.342  -1.641  1.00  0.00           H  
HETATM   41  H   UNL     1       9.255   1.644  -1.690  1.00  0.00           H  
HETATM   42  H   UNL     1       9.872   1.595  -0.021  1.00  0.00           H  
HETATM   43  H   UNL     1      10.159   0.222  -1.117  1.00  0.00           H  
HETATM   44  H   UNL     1       2.894   0.757   1.237  1.00  0.00           H  
HETATM   45  H   UNL     1       4.085   1.069  -0.050  1.00  0.00           H  
HETATM   46  H   UNL     1       1.821   2.068  -0.531  1.00  0.00           H  
HETATM   47  H   UNL     1       2.342   0.892  -1.763  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.611  -1.690   0.289  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.636   1.372   1.598  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.873   1.610   1.629  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.896   2.662   0.621  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.959  -3.065  -1.790  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.291  -2.074  -3.110  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.356  -2.310  -1.614  1.00  0.00           H  
HETATM   55  H   UNL     1       5.581   0.917   1.725  1.00  0.00           H  
HETATM   56  H   UNL     1       7.690   1.949   0.983  1.00  0.00           H  
CONECT    1   18   20    5    5                                       
CONECT    2   24   21    3    3                                       
CONECT    3    2    2   27   28                                       
CONECT    4   17   17                                                 
CONECT    5   17    1    1   29                                       
CONECT    6   29    7   32   33                                       
CONECT    7    6    8   34   35                                       
CONECT    8   15    7    9   36                                       
CONECT    9    8   10   37   38                                       
CONECT   10    9   11   11   30                                       
CONECT   11   10   10   12   39                                       
CONECT   12   11   13   13   40                                       
CONECT   13   12   12   31   14                                       
CONECT   14   13   41   42   43                                       
CONECT   15   16    8   44   45                                       
CONECT   16   29   15   46   47                                       
CONECT   17   18    4    4    5                                       
CONECT   18   19   19   17    1                                       
CONECT   19   18   18                                                 
CONECT   20   21    1   48                                            
CONECT   21   22   22    2   23                                       
CONECT   21   23   20                                                 
CONECT   22   21   21                                                 
CONECT   23   21   21                                                 
CONECT   24   25   26   26    2                                       
CONECT   25   24   49   50   51                                       
CONECT   26   24   24   27                                            
CONECT   27   26    3                                                 
CONECT   28    3   52   53   54                                       
CONECT   29    5   16    6                                            
CONECT   30   10   31   31   55                                       
CONECT   31   30   30   13   56                                       
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   20                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   25                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
