# Details of computing
0: PETQUC.cif
1: PETRAJ.cif
2: PETREN.cif
3: PETRIR.cif
4: PETROX.cif
-------------------------------------
0
1
2
3
4
0
0.0000
0.0274
0.0054
0.0071
3.4610
1
0.0274
0.0000
0.0272
0.0305
3.4792
2
0.0054
0.0272
0.0000
0.0055
3.4597
3
0.0071
0.0305
0.0055
0.0000
3.4566
4
3.4610
3.4792
3.4597
3.4566
0.0000