TITLE s92 input file for XPREP
SOURCE  Mo  0.71073   
CHEM    C18 H12 N2 Se2 Cu1 Cl2 
CELL    3.78720    14.56570    22.44350    90.0000    91.7000    90.0000 
CELLSD  0.00029     0.00110     0.00210     0.0000     0.0031     0.0000