N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.8324 | 0.0000 | 0.3333 | 0.0000 | Ca=0.5900, Ce=0.3450, Na=0.0600, Th=0.0150 |
2 | 0.3295 | 0.0000 | 0.3333 | 0.0000 | Ca=0.2500, Ce=0.2500, Th=0.2500, Na=0.2500 |
3 | 0.1653 | 0.6676 | 0.0166 | 0.0000 | Zr |
4 | 0.3330 | 0.0000 | 0.8333 | 0.0000 | Ti=0.7800, Nb=0.2140, Ta=0.0060 |
5 | 0.4970 | 0.3340 | 0.1640 | 0.0000 | Ti=0.6900, Nb=0.1550, Ta=0.1550 |
6 | 0.0440 | 0.8940 | 0.1690 | 0.0000 | Fe=0.5000 |
7 | 0.5950 | 0.6340 | 0.1428 | 0.0000 | O |
8 | 0.0100 | 0.8200 | 0.0579 | 0.0000 | O |
9 | 0.5270 | 0.3140 | 0.0488 | 0.0000 | O |
10 | 0.2020 | 0.2270 | 0.1442 | 0.0000 | O |
11 | 0.5320 | 0.8900 | 0.0536 | 0.0000 | O |
12 | 0.9470 | 0.3120 | 0.0540 | 0.0000 | O |
13 | 0.2070 | 0.6160 | 0.1425 | 0.0000 | O |