PHARMACOSIDERITE [1], structure type - pharmacosiderite, DF

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.1426
0.1426
0.1426
1.1000
Fe
2
0.5000
0.0000
0.0000
1.5000
As
3
0.1223
0.1223
0.3787
1.8000
O
4
0.8847
0.8847
0.8847
1.2000
O
5
0.0680
0.5000
0.5000
3.3000
H2O=0.5000
6
0.6940
0.6940
0.6940
2.5000
H2O=0.5000