| N/N | x/a | y/b | z/c | B(j) | Occupancy |
|---|---|---|---|---|---|
| 1 | 0.0000 | 0.0000 | 0.0000 | 1.3500 | Hg |
| 2 | 0.2729 | 0.0774 | 0.2988 | 2.5000 | Hg |
| 3 | 0.3363 | 0.2767 | 0.2099 | 1.9300 | Hg |
| 4 | 0.5000 | 0.8167 | 0.2500 | 1.3300 | Cr |
| 5 | 0.3579 | 0.4508 | 0.1458 | 2.6400 | O |
| 6 | 0.5052 | 0.7335 | 0.0451 | 1.9200 | O |
| 7 | 0.3708 | 0.8940 | 0.2049 | 2.6800 | O |