N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.2890 | 0.0972 | 0.9774 | 0.0000 | Si |
2 | 0.2881 | 0.9135 | 0.4820 | 0.0000 | Si |
3 | 0.2137 | 0.5880 | 0.0196 | 0.0000 | Si |
4 | 0.2103 | 0.4027 | 0.5232 | 0.0000 | Si |
5 | 0.1120 | 0.0880 | 0.8640 | 0.0000 | O |
6 | 0.1100 | 0.9220 | 0.4050 | 0.0000 | O |
7 | 0.3860 | 0.5670 | 0.1030 | 0.0000 | O |
8 | 0.3850 | 0.4110 | 0.6200 | 0.0000 | O |
9 | 0.0000 | 0.1002 | 0.5000 | 0.0000 | Al=0.9500, Fe=0.0500 |
10 | 0.0000 | 0.9122 | 0.0000 | 0.0000 | Mg=0.8100, Fe=0.1900 |
11 | 0.5000 | 0.4045 | 0.0000 | 0.0000 | Al=0.8200, Fe=0.1800 |
12 | 0.5000 | 0.5957 | 0.5000 | 0.0000 | Mg=0.8000, Fe=0.2000 |
13 | 0.0000 | 0.3036 | 0.0000 | 0.0000 | Na=0.6400, Ca=0.3600 |
14 | 0.0000 | 0.7017 | 0.5000 | 0.0000 | Na=0.3600, Ca=0.6400 |
15 | 0.5000 | 0.8009 | 0.0000 | 0.0000 | Na=0.0300, Ca=0.9700 |
16 | 0.5000 | 0.1996 | 0.5000 | 0.0000 | Na=0.6400, Ca=0.3600 |
17 | 0.3640 | 0.2630 | 0.0660 | 0.0000 | O |
18 | 0.3470 | 0.7470 | 0.5510 | 0.0000 | O |
19 | 0.1330 | 0.7490 | 0.9390 | 0.0000 | O |
20 | 0.1350 | 0.2440 | 0.4460 | 0.0000 | O |
21 | 0.3600 | 0.0220 | 0.7570 | 0.0000 | O |
22 | 0.3500 | 0.9940 | 0.2520 | 0.0000 | O |
23 | 0.1540 | 0.5150 | 0.2550 | 0.0000 | O |
24 | 0.1470 | 0.4890 | 0.7500 | 0.0000 | O |