# Details of computing
0: YEKQAG.cif
1: YEKQAG01.cif
2: YEKQAG03.cif


-------------------------------------

	0	1	2
0	0.0000	0.0152	0.0282
1	0.0152	0.0000	0.0401
2	0.0282	0.0401	0.0000