AGARDITE-(Y) [2], structure type - mixite

Atomic Positions

N/Nx/ay/bz/cB(j)Occupancy
1
0.4130
0.3160
0.5023
0.0000
Cu
2
0.6667
0.3333
0.2500
0.0000
Y=0.5200, Er=0.0500, Ca=0.4300
3
0.4950
0.1510
0.7500
0.0000
As=0.8280, P=0.1720
4
0.5739
0.1820
0.5182
0.0000
O
5
0.3919
0.4007
0.2500
0.0000
O
6
0.4124
0.2123
0.7500
0.0000
O
7
0.3688
0.3768
0.7500
0.0000
OH
8
0.4421
0.2456
0.2500
0.0000
OH
9
0.1338
0.1703
0.2500
0.0000
H2O=0.7680
10
0.0000
0.0000
0.5000
0.0000
H2O=0.6970