# Details of computing
0: NMHCOU.cif
1: NMHCOU01.cif
2: XEQGUX.cif
3: XEQGUX01.cif


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

	0	1	2	3
0	0.0000	51.5280	21.2120	35.7837
1	51.5280	0.0000	41.8669	42.1611
2	21.2120	41.8669	0.0000	35.9462
3	35.7837	42.1611	35.9462	0.0000