# Details of computing
0: XEMXIY.cif
1: XEMXIY01.cif
2: XEMXIY02.cif
-------------------------------------
0
1
2
0
0.0000
0.1580
0.1708
1
0.1580
0.0000
0.0249
2
0.1708
0.0249
0.0000