VERSILIAITE [1], DN

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.3084
0.3193
0.0000
1.2000
Fe=0.7500, Sb=0.2500
2
0.0000
0.5000
0.3752
0.3200
Fe
3
0.0000
0.5000
0.1239
0.3600
Fe=0.7500, Zn=0.2500
4
0.1711
0.1671
0.2450
0.2300
Sb=0.9000, As=0.1000
5
0.3303
0.3292
0.5000
0.3800
Sb=0.9000, As=0.1000
6
0.5000
0.5000
0.0000
1.1500
(S)=0.8000
7
0.3610
0.0993
0.5000
0.3000
O
8
0.4003
0.1360
0.2438
0.2700
O
9
0.3234
0.8176
0.3764
0.9300
O
10
0.1855
0.3428
0.1357
0.7200
O
11
0.6070
0.8915
0.0000
0.6600
O