| ╧ п/п | x/a | y/b | z/c | B(j) | Заселенность |
|---|---|---|---|---|---|
| 1 | 0.3333 | 0.6667 | 0.0067 | 0.0000 | Na |
| 2 | 0.2534 | 0.9990 | 0.2500 | 0.0000 | Na=0.7120, Bi=0.2880 |
| 3 | 0.4029 | 0.3742 | 0.2500 | 0.0000 | S |
| 4 | 0.3320 | 0.4775 | 0.2500 | 0.0000 | O |
| 5 | 0.5776 | 0.4664 | 0.2500 | 0.0000 | O |
| 6 | 0.3543 | 0.2695 | 0.0800 | 0.0000 | O |
| 7 | 0.0000 | 0.0000 | 0.0000 | 0.0000 | (Cl)=0.7400, (Br)=0.0700 |
| 8 | 0.0000 | 0.0000 | 0.2500 | 0.0000 | H2O=0.1900 |