# Details of computing
0: IJUXEQ.cif
1: IJUXEQ01.cif
2: IJUXEQ02.cif


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

	0	1	2
0	0.0000	1.5353	1.7321
1	1.5353	0.0000	0.1352
2	1.7321	0.1352	0.0000