N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0000 | 0.9709 | 0.2500 | 0.0000 | Na |
2 | 0.7890 | 0.8400 | -0.1279 | 0.0000 | Fe |
3 | 0.5000 | 0.7833 | 0.2500 | 0.0000 | Fe |
4 | 0.7836 | 0.8887 | 0.3862 | 0.0000 | P |
5 | 0.5000 | 0.8197 | -0.2500 | 0.0000 | P |
6 | 0.7855 | 0.8205 | 0.1928 | 0.0000 | O |
7 | 0.6451 | 0.9085 | 0.3436 | 0.0000 | O |
8 | 0.8460 | 0.8286 | 0.6107 | 0.0000 | O |
9 | 0.8456 | 0.9975 | 0.3987 | 0.0000 | O |
10 | 0.6070 | 0.8941 | -0.2321 | 0.0000 | O |
11 | 0.5348 | 0.7483 | -0.0381 | 0.0000 | O |