╧ п/п | x/a | y/b | z/c | B(j) | Заселенность |
---|---|---|---|---|---|
1 | 0.5000 | 0.3856 | 0.7500 | 0.0000 | Ca |
2 | 0.3132 | 0.0818 | 0.1867 | 0.0000 | Mg=0.9630, Mn=0.0370 |
3 | 0.3245 | 0.4697 | 0.1373 | 0.0000 | Ca |
4 | 0.4148 | 0.3063 | 0.4082 | 0.0000 | As |
5 | 0.6622 | 0.2287 | 0.6187 | 0.0000 | As |
6 | 0.4261 | 0.4305 | 0.2939 | 0.0000 | O |
7 | 0.3380 | 0.2191 | 0.3529 | 0.0000 | O |
8 | 0.4113 | 0.3772 | 0.5613 | 0.0000 | O |
9 | 0.6675 | 0.2381 | 0.4510 | 0.0000 | O |
10 | 0.7062 | 0.0834 | 0.6839 | 0.0000 | O |
11 | 0.7037 | 0.3739 | 0.6914 | 0.0000 | O |
12 | 0.5741 | 0.2234 | 0.6461 | 0.0000 | O |
13 | 0.4853 | 0.1862 | 0.4216 | 0.0000 | OH |
14 | 0.5128 | 0.1980 | 0.4930 | 0.0000 | H |
15 | 0.2347 | 0.4184 | 0.4662 | 0.0000 | H2O |
16 | 0.2063 | 0.3850 | 0.5090 | 0.0000 | H |
17 | 0.2506 | 0.3620 | 0.4200 | 0.0000 | H |
18 | 0.5861 | 0.0009 | 0.8284 | 0.0000 | H2O |
19 | 0.5738 | 0.0610 | 0.7770 | 0.0000 | H |
20 | 0.5554 | -0.0450 | 0.8500 | 0.0000 | H |