# Details of computing
0: CASNAO.cif
1: HPCBDP10.cif
2: HPCBDP11.cif


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

	0	1	2
0	0.0000	4.3683	16.3399
1	4.3683	0.0000	21.2262
2	16.3399	21.2262	0.0000