N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.5134 | 0.2366 | 0.8750 | 1.5000 | Zr=0.1600, Mn=0.0900 |
2 | 0.8383 | 0.2321 | 0.3604 | 1.0200 | Zr |
3 | 0.3320 | 0.0820 | 0.3750 | 0.5500 | Ti=0.1500, Sb=0.3400 |
4 | 0.6678 | 0.0822 | 0.3750 | 0.6400 | Ca=0.4000, Mn=0.1600, Na=0.0400 |
5 | 0.2435 | 0.1719 | 0.7054 | 0.7500 | O |
6 | 0.0654 | 0.1707 | -0.0059 | 0.7700 | O |
7 | 0.6141 | 0.1667 | 0.0014 | 0.9600 | O |
8 | 0.2500 | 0.0373 | 0.5000 | 0.7800 | O |
9 | 0.2500 | 0.1806 | 0.0000 | 0.7000 | O |