TITLE s92 input file for XPREP
SOURCE  Mo  0.71073   
CHEM    C18 H17 N3 O4 
CELL    11.27280    12.43980    13.03980    65.8565    82.0774    86.2926 
CELLSD  0.00050     0.00059     0.00080     0.0020     0.0019     0.0025