N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.2761 | 0.8549 | 0.5558 | 0.0000 | Fe |
2 | 0.1201 | 0.3403 | 0.6878 | 0.0000 | Te |
3 | 0.3384 | 0.1658 | 0.1697 | 0.0000 | Te |
4 | 0.1934 | 0.5929 | 0.5382 | 0.0000 | O |
5 | 0.3628 | 0.1361 | 0.5839 | 0.0000 | O |
6 | 0.4048 | 0.3169 | 0.8053 | 0.0000 | O |
7 | 0.4490 | 0.4410 | 0.7920 | 0.0000 | H |
8 | 0.5437 | 0.2849 | 0.2623 | 0.0000 | O |
9 | 0.1128 | 0.0390 | 0.3549 | 0.0000 | O |
10 | 0.0984 | 0.4276 | 0.1255 | 0.0000 | O |
11 | 0.0600 | 0.4700 | 0.0280 | 0.0000 | H=0.5000 |
12 | 0.0000 | 0.0000 | 0.0000 | 0.0000 | (Cl) |