N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.5705 | 0.1670 | 0.2101 | 0.0000 | Al=0.7500, Si=0.2500 |
2 | 0.0000 | 0.5000 | 0.5000 | 0.0000 | Mg=0.6700, Al=0.3300 |
3 | 0.5000 | 0.3292 | 0.5000 | 0.0000 | Mg=0.6700, Al=0.2600, Fe=0.0700 |
4 | 0.5000 | 0.5000 | 0.0000 | 0.0000 | Ca |
5 | 0.4265 | 0.0000 | 0.1523 | 0.0000 | O |
6 | 0.8627 | 0.1878 | 0.1512 | 0.0000 | O |
7 | 0.6316 | 0.1689 | 0.3889 | 0.0000 | O |
8 | 0.6277 | 0.5000 | 0.3990 | 0.0000 | OH |