N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.2500 | 0.5000 | 0.0000 | 0.0000 | Cu |
2 | 0.2080 | 0.0000 | 0.0000 | 0.0000 | Cu=0.6670 |
3 | 0.2608 | 0.2608 | 0.2608 | 0.0000 | Te=0.7000, Sb=0.2250, As=0.0750 |
4 | 0.1070 | 0.1070 | 0.3540 | 0.0000 | (S)=0.9500, (Se)=0.0500 |
5 | 0.0000 | 0.0000 | 0.0000 | 0.0000 | (S)=0.3000 |