| N/N | x/a | y/b | z/c | B(j) | Occupancy |
|---|---|---|---|---|---|
| 1 | 0.3296 | 0.3296 | 0.3296 | 0.0000 | Na=0.7500, Zn=0.2500 |
| 2 | 0.2500 | 0.3750 | 0.0000 | 0.0000 | (Cl) |
| 3 | 0.2500 | 0.2683 | 0.5000 | 0.0000 | S |
| 4 | 0.4607 | 0.4607 | 0.4607 | 0.0000 | S |
| 5 | 0.3749 | 0.3486 | 0.1177 | 0.0000 | Na |
| 6 | 0.5178 | 0.2456 | 0.4568 | 0.0000 | Na=0.5000 |
| 7 | 0.0883 | 0.4744 | 0.4637 | 0.0000 | O |
| 8 | 0.2322 | 0.0339 | 0.4261 | 0.0000 | O |
| 9 | 0.0177 | 0.3227 | 0.0727 | 0.0000 | O |
| 10 | 0.4079 | 0.4079 | 0.4079 | 0.0000 | O |