N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0000 | 0.0000 | 0.0000 | 2.3800 | Pb |
2 | 0.2500 | 0.2500 | 0.5000 | 1.4400 | Cu |
3 | 0.9167 | 0.5000 | 0.2097 | 1.4500 | As=0.6170, S=0.3830 |
4 | 0.3426 | 0.5000 | 0.4204 | 1.9100 | O |
5 | 0.3083 | 0.0000 | 0.3267 | 2.3100 | O |
6 | 0.0308 | 0.2887 | 0.2623 | 1.8300 | O |
7 | 0.2084 | 0.5000 | 0.0180 | 2.8200 | O |