# Details of computing
0: BXCPAL.cif
1: FAYMUP.cif
2: FAYNAW.cif
3: RUJCII.cif
-------------------------------------
0
1
2
3
0
0.0000
57.8066
56.9646
62.3675
1
57.8066
0.0000
60.8950
34.2050
2
56.9646
60.8950
0.0000
56.0476
3
62.3675
34.2050
56.0476
0.0000