N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.2646 | 0.3376 | 0.3964 | 0.6000 | Cu |
2 | 0.1755 | 0.2177 | 0.0411 | 0.5500 | Si |
3 | 0.1805 | 0.1095 | 0.0825 | 0.6700 | O |
4 | 0.3520 | 0.3860 | 0.6019 | 0.5600 | O |
5 | 0.1605 | 0.2681 | 0.2141 | 0.7200 | O |
6 | 0.1408 | 0.1804 | 0.5783 | 1.7900 | O |
7 | 0.1512 | 0.1223 | 0.5567 | 3.3400 | H |
8 | 0.1108 | 0.1743 | 0.6911 | 2.4600 | H |