KATOITE [8], structure type -
garnet
, at 200'K,
DN
Atomic Positions
N/N
x/a
y/b
z/c
B(j)
Occupancy
1
0.1250
0.0000
0.2500
0.0000
Ca=0.9720
2
0.0000
0.0000
0.0000
0.0000
Al
3
0.3750
0.0000
0.2500
0.0000
Si=0.3640
4
0.0324
0.0498
0.6445
0.0000
O
5
0.0750
0.0610
0.6550
0.0000
H=0.6360