N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.1356 | 0.3037 | 0.1248 | 0.0000 | Si=0.7720, Al=0.2280 |
2 | 0.1363 | 0.3122 | 0.3724 | 0.0000 | Si=0.7720, Al=0.2280 |
3 | 0.0512 | 0.4110 | 0.2433 | 0.0000 | Si=0.7720, Al=0.2280 |
4 | 0.1386 | 0.1846 | 0.2541 | 0.0000 | Si=0.7720, Al=0.2280 |
5 | 0.0000 | 0.2399 | 0.0000 | 0.0000 | Si=0.7720, Al=0.2280 |
6 | 0.0699 | 0.2937 | 0.0495 | 0.0000 | O |
7 | 0.0664 | 0.3136 | 0.4475 | 0.0000 | O |
8 | 0.1195 | 0.2338 | 0.1806 | 0.0000 | O |
9 | 0.1247 | 0.2331 | 0.3299 | 0.0000 | O |
10 | 0.1062 | 0.3806 | 0.1677 | 0.0000 | O |
11 | 0.1060 | 0.3810 | 0.3188 | 0.0000 | O |
12 | 0.2500 | 0.3104 | 0.0971 | 0.0000 | O |
13 | 0.2500 | 0.3219 | 0.4007 | 0.0000 | O |
14 | 0.0656 | 0.1142 | 0.2550 | 0.0000 | O |
15 | 0.0546 | 0.5000 | 0.2435 | 0.0000 | O |
16 | 0.2500 | 0.1508 | 0.2540 | 0.0000 | O |
17 | 0.2500 | 0.0000 | 0.0417 | 0.0000 | Na=0.5300, K=0.1000, Ca=0.0800 |
18 | 0.2500 | 0.0000 | 0.4558 | 0.0000 | Na=0.4500, K=0.0900, Ca=0.0700 |
19 | 0.0482 | 0.0624 | 0.0446 | 0.0000 | Na=0.1000, K=0.0200, Ca=0.0100 |
20 | 0.0369 | 0.0634 | 0.4792 | 0.0000 | Na=0.1900, K=0.0400, Ca=0.0300 |
21 | 0.1611 | 0.0000 | 0.2386 | 0.0000 | Na=0.1900, K=0.0400, Ca=0.0300 |
22 | 0.1911 | 0.1160 | 0.0519 | 0.0000 | O=0.4900 |
23 | 0.0894 | 0.0824 | 0.4356 | 0.0000 | O=0.4100 |
24 | 0.2500 | 0.1259 | 0.0557 | 0.0000 | O=0.3200 |
25 | 0.2500 | 0.1313 | 0.4421 | 0.0000 | O=0.9100 |
26 | 0.1750 | 0.0000 | 0.1764 | 0.0000 | O=0.3800 |
27 | 0.2177 | 0.0000 | 0.3221 | 0.0000 | O=0.4600 |
28 | 0.0915 | 0.0000 | 0.1217 | 0.0000 | O=0.5000 |
29 | 0.1479 | 0.0000 | 0.3869 | 0.0000 | O=0.5000 |
30 | 0.2174 | 0.5000 | 0.0917 | 0.0000 | O=0.2000 |
31 | 0.1966 | 0.5000 | 0.4154 | 0.0000 | O=0.4200 |
32 | 0.1251 | 0.5000 | 0.0607 | 0.0000 | O=0.8300 |
33 | 0.0814 | 0.5000 | 0.4349 | 0.0000 | O=0.5000 |
34 | 0.2500 | 0.5000 | 0.1615 | 0.0000 | O=0.5000 |
35 | 0.2500 | 0.5000 | 0.3615 | 0.0000 | O=0.5000 |