# Details of computing
1: PTSBZA.cif
2: PTSBZA01.cif
3: PTSBZA02.cif
4: PTSBZA03.cif
5: QUDPUC.cif
-------------------------------------
1
2
3
4
5
1
0.0000
0.0764
0.1630
0.1494
33.2825
2
0.0764
0.0000
0.1886
0.1670
32.6263
3
0.1630
0.1886
0.0000
0.2683
32.2929
4
0.1494
0.1670
0.2683
0.0000
34.0786
5
33.2825
32.6263
32.2929
34.0786
0.0000