# Details of computing
0: MOKRUA.cif
1: MOLKEE.cif
2: XEBYUA.cif
3: XEBYUA01.cif
-------------------------------------
0
1
2
3
0
0.0000
66.1922
77.3252
77.6608
1
66.1922
0.0000
67.3871
67.0677
2
77.3252
67.3871
0.0000
0.1338
3
77.6608
67.0677
0.1338
0.0000