N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.4264 | 0.5138 | 0.3510 | 0.0100 | Cu |
2 | 0.0230 | 0.2500 | 0.2214 | 0.0100 | Cu |
3 | 0.3649 | 0.1032 | 0.1004 | 0.0100 | As |
4 | 0.0190 | 0.1463 | 0.5231 | 0.0100 | O |
5 | 0.0240 | 0.0351 | 0.3188 | 0.0100 | O |
6 | 0.1160 | 0.0611 | 0.0365 | 0.0100 | O |
7 | 0.2750 | 0.5962 | 0.2386 | 0.0100 | H2O |
8 | 0.2800 | 0.1745 | 0.2150 | 0.0100 | O |
9 | 0.2140 | 0.2500 | 0.8230 | 0.0300 | H2O |
10 | 0.3600 | 0.2500 | 0.4547 | 0.0100 | H2O |