ARSENOPYRITE [1], "distorted" structure type -
arsenopyrite
Atomic Positions
N/N
x/a
y/b
z/c
B(j)
Occupancy
1
0.1540
0.3710
0.3630
0.0000
(As)
2
0.1550
0.1290
0.8630
0.0000
(As)
3
0.2720
0.0000
0.2890
0.0000
Fe
4
0.2750
0.5020
0.7870
0.0000
Fe
5
0.3460
0.6300
0.1750
0.0000
(S)
6
0.3430
0.8690
0.6750
0.0000
(S)