N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.1842 | 0.2193 | 0.6971 | 0.0000 | Si |
2 | 0.1984 | 0.7937 | 0.6846 | 0.0000 | Si |
3 | 0.3139 | 0.2563 | 0.0664 | 0.0000 | P |
4 | 0.3011 | 0.4917 | 0.2839 | 0.0000 | Nb |
5 | 0.9724 | 0.0009 | 0.5079 | 0.0000 | Ti |
6 | 0.1832 | 0.9821 | 0.8997 | 0.0000 | Na |
7 | 0.1953 | 0.5079 | 0.8660 | 0.0000 | Na |
8 | 0.4945 | 0.2406 | 0.5010 | 0.0000 | Na |
9 | 0.7053 | 0.9926 | 0.7358 | 0.0000 | Na |
10 | 0.2493 | 0.7369 | 0.0803 | 0.0000 | Na |
11 | 0.0000 | 0.5000 | 0.5000 | 0.0000 | Na |
12 | 0.4349 | 0.3235 | 0.7427 | 0.0000 | O |
13 | 0.2036 | 0.0057 | 0.7350 | 0.0000 | O |
14 | 0.1614 | 0.8017 | 0.5738 | 0.0000 | O |
15 | 0.4602 | 0.7099 | 0.7190 | 0.0000 | O |
16 | 0.0518 | 0.6964 | 0.2550 | 0.0000 | O |
17 | 0.3231 | 0.5156 | 0.4057 | 0.0000 | O |
18 | 0.2563 | 0.4334 | 0.1302 | 0.0000 | O |
19 | 0.2369 | 0.0734 | 0.1081 | 0.0000 | O |
20 | 0.1602 | 0.2094 | 0.5855 | 0.0000 | O |
21 | 0.4118 | 0.7422 | 0.9434 | 0.0000 | O |
22 | 0.1710 | 0.2745 | 0.9710 | 0.0000 | O |
23 | 0.0173 | 0.3163 | 0.2722 | 0.0000 | O |
24 | 0.2687 | 0.0024 | 0.4230 | 0.0000 | O |