N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.5393 | 0.3465 | 0.2273 | 0.3700 | Si |
2 | 0.5376 | 0.1621 | 0.7310 | 0.3600 | Si |
3 | 0.3624 | 0.3382 | 0.1232 | 0.7300 | O |
4 | 0.3621 | 0.1767 | 0.6475 | 0.7400 | O |
5 | 0.6138 | 0.5090 | 0.3091 | 0.7600 | O |
6 | 0.6063 | 0.9974 | 0.8054 | 0.8000 | O |
7 | 0.6057 | 0.2663 | 0.0037 | 0.6500 | O |
8 | 0.5981 | 0.2398 | 0.4984 | 0.7000 | O |
9 | 0.2500 | 0.3480 | 0.7500 | 0.3200 | Al=0.8680, Fe=0.1320 |
10 | 0.2500 | 0.1580 | 0.2500 | 0.4300 | Mg=0.8150, Fe=0.1850 |
11 | 0.2500 | 0.5521 | 0.2500 | 0.8600 | Na=0.6860, Ca=0.3140 |
12 | 0.2500 | 0.9502 | 0.7500 | 0.8200 | Ca=0.7160, Na=0.2840 |