N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.9660 | 0.0050 | 0.0020 | 0.0000 | Mn |
2 | 0.5120 | 0.2600 | 0.0100 | 0.0000 | Ti |
3 | 0.9250 | 0.7950 | 0.2530 | 0.0000 | Ti |
4 | 0.5250 | 0.9450 | 0.7200 | 0.0000 | Ti |
5 | 0.4250 | 0.0970 | 0.2330 | 0.0000 | Si |
6 | 0.4250 | 0.5550 | 0.2300 | 0.0000 | Si |
7 | 0.0750 | 0.2100 | 0.7500 | 0.0000 | Si |
8 | 0.0850 | 0.7250 | 0.7450 | 0.0000 | Si |
9 | 0.9900 | 0.5100 | 0.0000 | 0.0000 | Na |
10 | 0.4920 | 0.7750 | 0.0000 | 0.0000 | Na |
11 | 0.3500 | 0.0600 | 0.0850 | 0.0000 | O |
12 | 0.3500 | 0.5420 | 0.0840 | 0.0000 | O |
13 | 0.8620 | 0.2200 | 0.0910 | 0.0000 | O |
14 | 0.8620 | 0.7870 | 0.1000 | 0.0000 | O |
15 | 0.4250 | 0.2700 | 0.2500 | 0.0000 | O |
16 | 0.1750 | 0.0000 | 0.2750 | 0.0000 | O |
17 | 0.1750 | 0.6050 | 0.2710 | 0.0000 | O |
18 | 0.6520 | 0.0000 | 0.2990 | 0.0000 | O |
19 | 0.6620 | 0.6000 | 0.2750 | 0.0000 | O |
20 | 0.9450 | 0.3000 | 0.4390 | 0.0000 | O |
21 | 0.9850 | 0.8080 | 0.4550 | 0.0000 | O |
22 | 0.5100 | 0.4500 | 0.5430 | 0.0000 | O |
23 | 0.5000 | 0.9500 | 0.5170 | 0.0000 | O |
24 | 0.3030 | 0.2100 | 0.7040 | 0.0000 | O |
25 | 0.3150 | 0.7550 | 0.7160 | 0.0000 | O |
26 | 0.8350 | 0.2000 | 0.7270 | 0.0000 | O |
27 | 0.8230 | 0.7100 | 0.6950 | 0.0000 | O |
28 | 0.0650 | 0.4750 | 0.7500 | 0.0000 | O |
29 | 0.1100 | 0.2000 | 0.8950 | 0.0000 | O |
30 | 0.1250 | 0.7630 | 0.9000 | 0.0000 | O |
31 | 0.6230 | 0.4970 | 0.8930 | 0.0000 | O |
32 | 0.6250 | 0.0000 | 0.9050 | 0.0000 | O |