N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.7500 | 0.7500 | 0.7500 | 0.0100 | P |
2 | 0.8758 | 0.8758 | 0.8758 | 0.0200 | (Se) |
3 | 0.2500 | 0.2500 | 0.2500 | 0.0300 | (Se) |
4 | 0.5000 | 0.5000 | 0.5000 | 0.0300 | (Se) |
5 | 0.0787 | 0.0787 | 0.2673 | 0.0500 | Cu=0.3140 |
6 | 0.0160 | 0.0160 | 0.2757 | 0.0700 | Cu=0.1790 |
7 | 0.1286 | 0.1286 | 0.3714 | 0.2400 | Cu=0.2700 |