N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.4216 | 0.4094 | 0.2472 | 0.5200 | Si |
2 | 0.0000 | 0.0000 | 0.0000 | 0.6800 | Zr=0.7000, Ti=0.2000, Nb=0.1000 |
3 | 0.3333 | 0.6667 | 0.1663 | 0.6600 | Y=0.8000, Dy=0.0060, Gd=0.0500 |
4 | 0.0000 | 0.0000 | 0.1955 | 2.2000 | Na |
5 | 0.3590 | 0.0000 | 0.5000 | 4.1000 | Na=0.8000, K=0.2000 |
6 | 0.0960 | 0.1760 | 0.0795 | 1.0000 | O |
7 | 0.1040 | 0.2070 | 0.5732 | 1.2000 | O |
8 | 0.6590 | 0.0000 | 0.0000 | 0.9000 | O |
9 | 0.6410 | 0.0000 | 0.5000 | 1.3000 | O |
10 | 0.5010 | 0.1400 | 0.0593 | 1.7000 | H2O |
11 | 0.5300 | 0.4300 | 0.0400 | 0.0000 | H |
12 | 0.4800 | 0.6800 | 0.0000 | 0.0000 | H |