N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.2799 | 0.3450 | 0.1840 | 0.6700 | Ca |
2 | 0.0960 | 0.6801 | 0.2429 | 0.6400 | Ca |
3 | 0.8465 | 0.0086 | 0.2670 | 0.7000 | Ca |
4 | 0.3041 | 0.0488 | 0.2772 | 0.4900 | Si |
5 | 0.6243 | 0.6615 | 0.3290 | 0.4800 | Si |
6 | 0.8020 | 0.3761 | 0.2703 | 0.5100 | Si |
7 | 0.1928 | 0.0874 | 0.0902 | 0.8300 | O |
8 | 0.5003 | 0.9696 | 0.2131 | 0.9900 | O |
9 | 0.1594 | 0.9480 | 0.3668 | 0.7500 | O |
10 | 0.3938 | 0.2132 | 0.4471 | 0.8000 | O |
11 | 0.7694 | 0.7254 | 0.1969 | 0.6800 | O |
12 | 0.4085 | 0.5931 | 0.2071 | 0.6700 | O |
13 | 0.7211 | 0.5330 | 0.4128 | 0.7100 | O |
14 | 0.6082 | 0.2950 | 0.0911 | 0.8200 | O |
15 | 0.8560 | 0.2716 | 0.4015 | 0.7900 | O |
16 | 0.9748 | 0.4193 | 0.1475 | 0.7300 | O |
17 | 0.5240 | 0.1010 | 0.8780 | 3.0000 | H |
18 | 0.6020 | 0.3420 | 0.9800 | 0.8000 | H |