N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.3809 | 0.3500 | -0.0063 | 0.9400 | Fe |
2 | 0.3816 | 0.3660 | 0.1234 | 0.8900 | Fe |
3 | 0.3587 | 0.3975 | 0.2501 | 0.7500 | Fe |
4 | 0.3750 | 0.3528 | 0.3750 | 1.4100 | Fe |
5 | 0.2061 | 0.3660 | -0.0618 | 0.7800 | (S) |
6 | 0.5418 | 0.3833 | 0.0598 | 0.6100 | (S) |
7 | 0.2096 | 0.3858 | 0.1805 | 0.5000 | (S) |
8 | 0.5428 | 0.3645 | 0.3087 | 0.6500 | (S) |