# Details of computing
0: XAGNID.cif
1: XAGNID01.cif
2: GEHFIL.cif
3: XAGNID02.cif
-------------------------------------
0
1
2
3
0
0.0000
0.3006
51.7581
0.3006
1
0.3006
0.0000
50.1346
0.0000
2
51.7581
50.1346
0.0000
53.1768
3
0.3006
0.0000
53.1768
0.0000