COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.191  -1.872   2.046  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.476  -1.398   1.187  1.00  0.00           C  
HETATM    3  N   UNL     1      -3.768  -1.479  -0.119  1.00  0.00           N  
HETATM    4  S   UNL     1      -2.546  -0.704  -0.945  1.00  0.00           S  
HETATM    5  O   UNL     1      -1.838  -1.711  -1.653  1.00  0.00           O  
HETATM    6  O   UNL     1      -3.121   0.471  -1.501  1.00  0.00           O  
HETATM    7  N   UNL     1      -1.534  -0.208   0.287  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.205  -0.681   1.506  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.331   0.499   0.183  1.00  0.00           C  
HETATM   10  C   UNL     1       0.875  -0.183   0.165  1.00  0.00           C  
HETATM   11  C   UNL     1       2.071   0.525   0.062  1.00  0.00           C  
HETATM   12  C   UNL     1       2.050   1.915  -0.028  1.00  0.00           C  
HETATM   13  C   UNL     1       0.847   2.591  -0.017  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.344   1.890   0.086  1.00  0.00           C  
HETATM   15  O   UNL     1      -1.528   2.560   0.097  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.216   3.950  -0.009  1.00  0.00           C  
HETATM   17  C   UNL     1       3.364  -0.202   0.049  1.00  0.00           C  
HETATM   18  C   UNL     1       4.461   0.310   0.740  1.00  0.00           C  
HETATM   19  C   UNL     1       5.662  -0.370   0.724  1.00  0.00           C  
HETATM   20  C   UNL     1       5.778  -1.557   0.024  1.00  0.00           C  
HETATM   21  C   UNL     1       4.693  -2.070  -0.664  1.00  0.00           C  
HETATM   22  C   UNL     1       3.486  -1.401  -0.651  1.00  0.00           C  
HETATM   23  H   UNL     1      -4.547  -1.905  -0.510  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.428   0.174   2.145  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.538  -1.357   2.040  1.00  0.00           H  
HETATM   26  H   UNL     1       0.888  -1.260   0.236  1.00  0.00           H  
HETATM   27  H   UNL     1       2.977   2.464  -0.108  1.00  0.00           H  
HETATM   28  H   UNL     1       0.833   3.669  -0.088  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.678   4.132  -0.940  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.139   4.531  -0.004  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.595   4.249   0.834  1.00  0.00           H  
HETATM   32  H   UNL     1       4.371   1.237   1.287  1.00  0.00           H  
HETATM   33  H   UNL     1       6.512   0.025   1.259  1.00  0.00           H  
HETATM   34  H   UNL     1       6.720  -2.086   0.014  1.00  0.00           H  
HETATM   35  H   UNL     1       4.789  -2.997  -1.210  1.00  0.00           H  
HETATM   36  H   UNL     1       2.639  -1.802  -1.188  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    8                                       
CONECT    3    2    4   23                                            
CONECT    4    3    5    5    6                                       
CONECT    4    6    7                                                 
CONECT    5    4    4                                                 
CONECT    6    4    4                                                 
CONECT    7    4    8    9                                            
CONECT    8    2    7   24   25                                       
CONECT    9    7   10   10   14                                       
CONECT   10    9    9   11   26                                       
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   13   27                                       
CONECT   13   12   14   14   28                                       
CONECT   14    9   13   13   15                                       
CONECT   15   14   16                                                 
CONECT   16   15   29   30   31                                       
CONECT   17   11   18   18   22                                       
CONECT   18   17   17   19   32                                       
CONECT   19   18   20   20   33                                       
CONECT   20   19   19   21   34                                       
CONECT   21   20   22   22   35                                       
CONECT   22   17   21   21   36                                       
CONECT   23    3                                                      
CONECT   24    8                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   18                                                      
CONECT   33   19                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
