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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=36515 Help
TitleFe(II)Fe(III)2(SO4)4 * 2H2O: a new Fe(II)-Fe(III) sulfate, synthesis and crystal structure.
AuthorsWildner, M.;Giester, G.
ReferenceZeitschrift fuer Kristallographie (1991) 196, 269-277
Link XRef SCOPUS Google
CompoundH4 Fe3 O18 S4 - Iron(II) diiron(III) sulfate dihydrate [AB2C4X18] [mP58] [e12 a] []
Cell5.127(1), 14.293(3), 8.425(2), 90., 92.64, 90.
P121/N1 (14) V=616.73
RemarksR=0.032000 : M =Fe :

Atom (site) Oxid. x, y, z, B, Occupancy
Fe1(2a)2
Fe2(4e)3
S1(4e)6
S2(4e)6
O1(4e)-2
O2(4e)-2
O3(4e)-2
O4(4e)-2
O5(4e)-2
O6(4e)-2
O7(4e)-2
O8(4e)-2
O9(4e)-2
H1(4e)1
H2(4e)1
0.50.50.501
0.740.340.0201
0.770.560.1701
0.280.320.2601
0.760.560.3501
0.740.470.1001
0.560.620.1101
0.020.600.1401
0.510.290.1901
0.280.420.3001
0.050.300.1601
0.260.270.4201
0.740.380.5101
0.680.330.530.021
0.890.390.550.021
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Fe1(2a)2
Fe2(4e)3
S1(4e)6
S2(4e)6
O1(4e)-2
O2(4e)-2
O3(4e)-2
O4(4e)-2
O5(4e)-2
O6(4e)-2
O7(4e)-2
O8(4e)-2
O9(4e)-2
H1(4e)1
H2(4e)1
0.010.010.00-.000.000.00
0.000.000.00-.00-.00-.00
0.000.000.00-.000.00-.00
0.000.000.00-.00-.000.00
0.020.020.00-.000.000.00
0.020.010.02-.00-.00-.00
0.010.010.020.00-.000.00
0.010.010.01-.000.000.00
0.010.010.010.000.000.00
0.010.000.01-.00-.00-.00
0.010.010.01-.00-.00-.00
0.010.010.000.000.000.00
0.010.010.02-.00-.000.00
000000
000000

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