N/N | x/a | y/b | z/c | B(j) | Occupancy |
---|---|---|---|---|---|
1 | 0.0829 | 0.2500 | 0.3810 | 1.5300 | Ca |
2 | 0.4033 | 0.2500 | 0.5271 | 1.5400 | V |
3 | 0.0954 | 0.0336 | 0.1839 | 1.1300 | Si |
4 | 0.3165 | 0.0431 | 0.3925 | 1.0900 | Si |
5 | 0.0846 | 0.1509 | 0.1765 | 1.3000 | O |
6 | 0.2945 | 0.1591 | 0.4124 | 1.9000 | O |
7 | 0.4477 | 0.0203 | 0.2962 | 1.3000 | O |
8 | 0.1617 | 0.9882 | 0.0423 | 1.2000 | O |
9 | 0.1847 | 0.9938 | 0.3176 | 1.8000 | O |
10 | 0.5515 | 0.2500 | 0.4570 | 2.8000 | O |
11 | 0.9471 | 0.1186 | 0.4700 | 4.0000 | O |
12 | 0.3709 | 0.2500 | 0.1387 | 4.6000 | O |
13 | 0.8092 | 0.2500 | 0.2806 | 8.4000 | O |