GYPSUM [4], structure type - gypsum, at 320'K

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.5000
0.0786
0.2500
0.5700
Ca
2
0.0000
0.0787
0.7500
0.5000
S
3
0.9616
0.1326
0.5512
1.1800
O
4
0.7571
0.0215
0.6653
0.9700
O
5
0.3784
0.1826
0.4654
1.7500
O
6
0.2504
0.1615
0.5009
3.5200
H
7
0.4023
0.2435
0.4900
3.0700
H