# Details of computing
0: PEXHEF.cif
1: PEXHEF01.cif
2: PEXHEF02.cif


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

	0	1	2
0	0.0000	26.5747	14.5590
1	26.5747	0.0000	15.0466
2	14.5590	15.0466	0.0000