# Details of computing
0: XECQAA.cif
1: XECQEE.cif
2: XECQII.cif
3: XECYEM.cif
-------------------------------------
0
1
2
3
0
0.0000
0.7184
33.4270
41.4579
1
0.7184
0.0000
38.0984
40.3415
2
33.4270
38.0984
0.0000
39.3210
3
41.4579
40.3415
39.3210
0.0000