# Details of computing
0: NUQXAA.cif
1: NUQXAA01.cif
2: NUQXAA02.cif
3: NUQXAA03.cif


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

	0	1	2	3
0	0.0000	0.0993	57.1652	41.9835
1	0.0993	0.0000	57.1895	41.8033
2	57.1652	57.1895	0.0000	58.2684
3	41.9835	41.8033	58.2684	0.0000