N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.1239 | 0.1553 | 0.4203 | 1.6700 | Si |
2 | 0.3708 | 0.3296 | 0.0935 | 1.9000 | Be |
3 | 0.0863 | 0.0000 | 0.2500 | 1.8300 | Ca |
4 | 0.5000 | 0.2500 | 0.3445 | 1.8900 | Ca |
5 | 0.4769 | 0.4769 | 0.4769 | 1.9000 | Li |
6 | 0.2296 | 0.2296 | 0.2296 | 2.6000 | Li |
7 | 0.1034 | 0.3934 | 0.0121 | 1.8100 | O |
8 | 0.0674 | 0.3824 | 0.2077 | 1.7800 | O |
9 | 0.3584 | 0.1495 | 0.2620 | 1.8600 | O |
10 | 0.3670 | 0.1824 | 0.4573 | 1.9000 | O |
11 | 0.3954 | 0.3954 | 0.3954 | 2.2000 | F |
12 | 0.1454 | 0.1454 | 0.1454 | 2.1000 | F |