# Details of computing
0: ETILOI.cif
1: PAXWAN.cif
2: PAXWAN01.cif
3: ROTENC.cif


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

	0	1	2	3
0	0.0000	77.7400	77.8542	66.9670
1	77.7400	0.0000	0.0388	85.1264
2	77.8542	0.0388	0.0000	85.0617
3	66.9670	85.1264	85.0617	0.0000