| N/N | x/a | y/b | z/c | B(j) | Occupancy |
|---|---|---|---|---|---|
| 1 | 0.5000 | 0.0000 | 0.0000 | 0.0000 | Cu |
| 2 | 0.1319 | 0.2500 | 0.1737 | 0.0000 | Pb |
| 3 | 0.8778 | 0.7500 | 0.1939 | 0.0000 | V |
| 4 | 0.8847 | 0.5070 | 0.2954 | 0.0000 | O |
| 5 | 0.0530 | 0.7500 | 0.0850 | 0.0000 | O |
| 6 | 0.7030 | 0.7500 | 0.0810 | 0.0000 | O |
| 7 | 0.6370 | 0.2500 | 0.0630 | 0.0000 | OH |
| 8 | 0.7100 | 0.2500 | -0.0200 | 0.0000 | H |