N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0000 | 0.0000 | 0.0000 | 2.1100 | Ca=0.7200, La=0.2300, Y=0.0500 |
2 | 0.5000 | 0.5000 | 0.5000 | 0.7700 | Zr=0.5800, La=0.1000, Mg=0.3200 |
3 | 0.3109 | 0.3109 | 0.3109 | 0.6900 | Mg=0.3000, Fe=0.6200 |
4 | 0.3475 | 0.1232 | 0.0216 | 0.7200 | Cr=0.3800, Fe=0.3500, Ti=0.1800 |
5 | 0.3084 | 0.7208 | 0.1459 | 0.6300 | Ti=0.9700, Al=0.0300 |
6 | 0.4761 | 0.0815 | 0.6398 | 0.7500 | Ti=0.9700, Al=0.0300 |
7 | 0.3058 | 0.6269 | 0.3801 | 0.9200 | O |
8 | 0.1523 | 0.2378 | 0.9393 | 1.1400 | O |
9 | 0.9211 | 0.4571 | 0.3002 | 0.4700 | O |
10 | 0.1427 | 0.5149 | 0.9908 | 1.1600 | O |
11 | 0.3901 | 0.4896 | 0.1345 | 1.1100 | O |
12 | 0.7104 | 0.2410 | 0.0699 | 0.5500 | O |
13 | 0.2120 | 0.2120 | 0.2120 | 0.5500 | O |