N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0000 | 0.0000 | 0.0000 | 0.5600 | Sb=0.4800, Mg=0.5200 |
2 | 0.0000 | 0.5000 | 0.0000 | 0.8700 | Fe=0.2400, Mg=0.7500 |
3 | 0.1247 | 0.1708 | 0.5000 | 0.8100 | Mg |
4 | 0.1275 | 0.3893 | 0.0000 | 0.8200 | Fe=0.1900, Mg=0.8100 |
5 | 0.2570 | 0.2710 | 0.0000 | 0.7500 | Fe=0.4600, Mg=0.5400 |
6 | 0.3746 | 0.1089 | 0.5000 | 0.8400 | Mg |
7 | 0.3728 | 0.3885 | 0.5000 | 0.8600 | Mg |
8 | 0.0686 | 0.0317 | 0.5000 | 0.9600 | O |
9 | 0.0629 | 0.2472 | 0.0000 | 0.8600 | O |
10 | 0.0702 | 0.4629 | 0.5000 | 1.2400 | O |
11 | 0.1991 | 0.1266 | 0.0000 | 0.9200 | O |
12 | 0.1834 | 0.3137 | 0.5000 | 1.2100 | O |
13 | 0.3117 | 0.0313 | 0.0000 | 0.8800 | O |
14 | 0.3208 | 0.2454 | 0.5000 | 1.0700 | O |
15 | 0.3006 | 0.4321 | 0.0000 | 0.8500 | O |
16 | 0.4507 | 0.1525 | 0.0000 | 0.9100 | O |
17 | 0.4500 | 0.3474 | 0.0000 | 0.9000 | O |
18 | -0.0115 | 0.2513 | 0.0000 | 0.8200 | B |
19 | 0.2373 | 0.0293 | 0.0000 | 0.8000 | B |