| N/N | x/a | y/b | z/c | B(j) | Occupancy |
|---|---|---|---|---|---|
| 1 | 0.4130 | 0.5000 | 0.7160 | 0.0000 | Bi |
| 2 | 0.5000 | 0.1650 | 0.0000 | 0.0000 | Fe |
| 3 | 0.3160 | 0.1660 | 0.3690 | 0.0000 | Si |
| 4 | 0.2950 | 0.3280 | -0.1440 | 0.0000 | O |
| 5 | 0.3170 | 0.0000 | -0.1280 | 0.0000 | O |
| 6 | 0.2190 | 0.1700 | 0.1430 | 0.0000 | O |
| 7 | 0.6840 | 0.0000 | 0.1450 | 0.0000 | OH |
| 8 | 0.0810 | 0.2480 | 0.4480 | 0.0000 | O |
| 9 | 0.3260 | 0.0000 | 0.4290 | 0.0000 | O |