# Details of computing
0: PBPACB.cif
1: PBPACB01.cif
2: XUQTEK.cif
3: PBPACB02.cif
4: PBPACB03.cif
-------------------------------------
0
1
2
3
4
0
0.0000
0.4297
0.4021
0.4021
0.4074
1
0.4297
0.0000
0.0361
0.0361
0.0223
2
0.4021
0.0361
0.0000
0.0000
0.0270
3
0.4021
0.0361
0.0000
0.0000
0.0270
4
0.4074
0.0223
0.0270
0.0270
0.0000