PETRUKITE [1], structure type - enargite

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.0000
0.8268
0.0000
0.0000
Sn=0.8900, In=0.0500
2
0.0000
0.1514
0.4983
0.8100
Cu=0.6200, Fe=0.3000, Zn=0.0800
3
0.2466
0.3255
0.9866
0.9300
Cu=0.6200, Fe=0.3000, Zn=0.0800
4
0.0000
0.8226
0.6454
0.0000
(S)
5
0.0000
0.1436
0.1166
0.0800
(S)
6
0.2598
0.3364
0.6188
0.0000
(S)