TITLE     tetrahydrothiophene
REMARK    THIS IS A SIMULATION BOX
CRYST1  100.000  100.000  100.000  90.00  90.00  90.00 P 1           1
MODEL        1
ATOM      1  C1  MOL     1      50.546  48.757  50.608  1.00  0.00            
ATOM      2  H1  MOL     1      51.236  48.907  51.438  1.00  0.00            
ATOM      3  H2  MOL     1      50.606  47.687  50.398  1.00  0.00            
ATOM      4  C2  MOL     1      50.676  49.647  49.368  1.00  0.00            
ATOM      5  H3  MOL     1      50.156  49.097  48.588  1.00  0.00            
ATOM      6  H4  MOL     1      51.686  49.687  48.948  1.00  0.00            
ATOM      7  C3  MOL     1      50.116  51.047  49.648  1.00  0.00            
ATOM      8  H5  MOL     1      50.046  51.597  48.708  1.00  0.00            
ATOM      9  H6  MOL     1      50.776  51.587  50.338  1.00  0.00            
ATOM     10  C4  MOL     1      48.746  50.677  50.238  1.00  0.00            
ATOM     11  H7  MOL     1      47.986  50.607  49.458  1.00  0.00            
ATOM     12  H8  MOL     1      48.486  51.477  50.938  1.00  0.00            
ATOM     13  S1  MOL     1      48.936  49.227  51.328  1.00  0.00            
TER
ENDMDL