# Details of computing
0: DHNPYE.cif
1: XMPRYO.cif
2: XMPRYO10.cif


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

	0	1	2
0	0.0000	35.1613	47.5629
1	35.1613	0.0000	0.2387
2	47.5629	0.2387	0.0000