TITLE s92 input file for XPREP
SOURCE  Mo  0.71073   
CHEM    C32 H40 N2 O8 
CELL    19.40250    8.99150    17.85510    90.0000    93.3125    90.0000 
CELLSD  0.00210     0.00110     0.00239     0.0000     0.0035     0.0000