╧ п/п | x/a | y/b | z/c | B(j) | Заселенность |
---|---|---|---|---|---|
1 | 0.0000 | 0.0612 | 0.2500 | 1.3500 | Ca |
2 | 0.0000 | 0.3308 | 0.2500 | 1.0300 | Ca |
3 | 0.0000 | 0.4708 | 0.2500 | 0.7500 | Mn=0.5000 |
4 | 0.2500 | 0.2500 | 0.0000 | 0.7900 | Fe |
5 | 0.0000 | 0.1715 | -0.2500 | 0.8400 | Fe |
6 | 0.5000 | 0.2994 | -0.2500 | 0.7400 | P |
7 | 0.2582 | 0.1155 | -0.0405 | 0.8700 | P |
8 | 0.6172 | 0.2604 | 0.7072 | 1.1300 | O |
9 | 0.4693 | 0.3366 | 0.5548 | 1.1200 | O |
10 | 0.3096 | 0.1749 | 0.0120 | 1.0600 | O |
11 | 0.3754 | 0.0872 | -0.1497 | 1.2400 | O |
12 | 0.1362 | 0.1178 | -0.2009 | 1.2400 | O |
13 | 0.2184 | 0.0856 | 0.1620 | 1.6900 | O |
14 | 0.3712 | 0.2715 | 0.2189 | 0.8800 | OH |
15 | 0.1614 | 0.3301 | 0.5292 | 2.1100 | H2O |
16 | 0.1122 | 0.0261 | 0.5826 | 1.5900 | H2O |
17 | 0.1188 | 0.4731 | 0.5723 | 3.6900 | H2O |