GILLESPITE [10], structure type -
gillespite
, at 9 kbar
Atomic Positions
N/N
x/a
y/b
z/c
B(j)
Occupancy
1
0.2500
0.7500
0.0000
0.0000
Ba
2
0.2500
0.2500
0.0908
0.0000
Fe
3
0.5195
0.9365
0.1550
0.0000
Si
4
0.4726
0.9726
0.2500
0.0000
O
5
0.7232
0.9978
0.1358
0.0000
O
6
0.3907
0.0292
0.0926
0.0000
O