ZIRKELITE [2], DN

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.8324
0.0000
0.3333
0.0000
Ca=0.5900, Ce=0.3450, Na=0.0600, Th=0.0150
2
0.3295
0.0000
0.3333
0.0000
Ca=0.2500, Ce=0.2500, Th=0.2500, Na=0.2500
3
0.1653
0.6676
0.0166
0.0000
Zr
4
0.3330
0.0000
0.8333
0.0000
Ti=0.7800, Nb=0.2140, Ta=0.0060
5
0.4970
0.3340
0.1640
0.0000
Ti=0.6900, Nb=0.1550, Ta=0.1550
6
0.0440
0.8940
0.1690
0.0000
Fe=0.5000
7
0.5950
0.6340
0.1428
0.0000
O
8
0.0100
0.8200
0.0579
0.0000
O
9
0.5270
0.3140
0.0488
0.0000
O
10
0.2020
0.2270
0.1442
0.0000
O
11
0.5320
0.8900
0.0536
0.0000
O
12
0.9470
0.3120
0.0540
0.0000
O
13
0.2070
0.6160
0.1425
0.0000
O