N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0000 | 0.9014 | 0.2500 | 1.9900 | Mg=0.5030, Fe=0.4970 |
2 | 0.0000 | 0.2630 | 0.2500 | 2.7600 | Mg=0.1330, Fe=0.8350, Ca=0.0320 |
3 | 0.2967 | 0.0893 | 0.2698 | 1.5800 | Si |
4 | 0.1240 | 0.0901 | 0.1567 | 1.8000 | O |
5 | 0.3783 | 0.2403 | 0.3619 | 2.7000 | O |
6 | 0.3510 | 0.0098 | 0.0493 | 3.3000 | O |