LAURELITE [1], DF

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.5845
0.6934
0.5000
0.0200
Pb=0.9550
2
0.5720
0.7100
0.0000
0.0500
Pb=0.0450
3
0.8855
0.5984
0.0000
0.0200
Pb=0.9550
4
0.8530
0.5680
0.5000
0.0000
Pb=0.0450
5
0.0000
0.0000
0.5000
0.0300
Pb=0.9550
6
0.0000
0.0000
0.0000
0.0400
Pb=0.0450
7
0.3333
0.6667
0.0000
0.0200
(Cl)
8
0.6667
0.3333
0.5000
0.0200
(Cl)
9
0.0480
0.6200
0.5000
0.0200
F
10
0.6090
0.5700
0.0000
0.0200
F
11
0.0790
0.8680
0.0000
0.0400
F
12
0.8340
0.7290
0.5000
0.0200
F