# Details of computing
0: ITIMAA.cif
1: ITIMEE.cif
2: ITIMEE01.cif
3: ITIMII.cif
4: XUBDEE.cif


-------------------------------------
01234
00.0000 4.6998 4.7091 0.1081 18.3450
14.6998 0.0000 0.0337 3.5107 18.7613
24.7091 0.0337 0.0000 3.5086 18.7660
30.1081 3.5107 3.5086 0.0000 18.1986
418.3450 18.7613 18.7660 18.1986 0.0000