N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.8559 | 0.1989 | 0.1584 | 1.0900 | O |
2 | 0.4530 | 0.0000 | 0.1651 | 0.9800 | O |
3 | 0.6348 | 0.1703 | 0.3905 | 0.9600 | O |
4 | 0.1252 | 0.0000 | 0.3989 | 1.2800 | O |
5 | 0.5740 | 0.1672 | 0.2139 | 0.6000 | Al=0.5000, Si=0.5000 |
6 | 0.0000 | 0.5000 | 0.5000 | 0.6000 | Mg=0.8500, Al=0.1500 |
7 | 0.0000 | 0.8302 | 0.5000 | 0.6200 | Mg=0.5000, Al=0.5000 |
8 | 0.0000 | 0.0000 | 0.0000 | 1.8300 | Na |
9 | 0.0830 | 0.0000 | 0.2950 | 1.0000 | H |